Huang, Linjie et al. published their research in Macromolecular Chemistry and Physics in 2020 |CAS: 79-07-2

The Article related to polypeptide thermoresponsive polymer ucst, Placeholder for records without volume info and other aspects.Related Products of 79-07-2

On July 15, 2020, Huang, Linjie; Sun, Liwei; Zhou, Congping; Ling, Ying; Lu, Hua; Luan, Shifang; Tang, Haoyu published an article.Related Products of 79-07-2 The title of the article was Preparation and Properties of UCST-Type Thermoresponsive Polypeptide Bearing Amide Pendants. And the article contained the following:

Thermoresponsive polypeptides bearing amide pendants with an upper critical solution temperature (UCST) under physiol. relevant solution conditions are developed. A series of poly(纬-propanyl-L-glutamate)s bearing amide pendants (PPLGn-Am) with different mol. weight (or d.p., DP) is prepared by copper mediated 1,3-dipolar cycloaddition While fourier transform infra-red and CD anal. reveal random coil conformation of the PPLGn-Am in the solid-state and in aqueous solutions, resp., PPLGn-Am shows reversible UCST-type phase behaviors in deionized water (DI) water and phosphate-buffered saline. Variable temperature UV-vis spectroscopy indicates that the UCST-type cloud point temperature (Tcp) in the range of 25-75 掳C can be readily tuned by mol. weight (or DP), polymer concentration, and incorporation of hydrophobic (i.e., n-hexyl) pendants. Moreover, PPLGn-Am is readily degraded by proteinase K within 48 h. The results indicate that UCST-type thermoresponsive and biodegradable polypeptides in aqueous solutions can be constructed by conjugation of amide pendants which shall provide guidance for future UCST polymer designs. The experimental process involved the reaction of 2-Chloroacetamide(cas: 79-07-2).Related Products of 79-07-2

The Article related to polypeptide thermoresponsive polymer ucst, Placeholder for records without volume info and other aspects.Related Products of 79-07-2

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Saluti, Giorgio et al. published their research in Separations in 2021 |CAS: 144-80-9

The Article related to egg sample antibiotic residue survey italy, Placeholder for records without volume info and other aspects.Electric Literature of 144-80-9

Saluti, Giorgio; Colagrande, Maria Novella; Castellani, Federica; Ricci, Matteo; Diletti, Gianfranco; Scortichini, Giampiero published an article in 2021, the title of the article was Survey on Antibiotic Residues in Egg Samples in Italy.Electric Literature of 144-80-9 And the article contains the following content:

The presence of antibiotic residue in eggs is a current issue due to the increasingly important phenomenon of antibiotic resistance. A multiclass, confirmatory method for the determination of seventy-three antimicrobial agents (amphenicols, cephalosporins, diaminopyrimidines, lincosamides, macrolides, penicillins, pleuromutilins, quinolones, sulfonamides, and tetracyclines) with liquid chromatog. high-resolution mass spectrometry was applied to 200 egg samples collected from 119 Italian farms during the years 2018-2021. The experimental process involved the reaction of N-((4-Aminophenyl)sulfonyl)acetamide(cas: 144-80-9).Electric Literature of 144-80-9

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Henschel, Henning et al. published their research in Journal of Chemical Theory and Computation in 2020 |CAS: 685-91-6

The Article related to ir spectrum similarity force field database, Placeholder for records without volume info and other aspects.Safety of N,N-Diethylacetamide

On May 12, 2020, Henschel, Henning; Andersson, Alfred T.; Jespers, Willem; Mehdi Ghahremanpour, Mohammad; van der Spoel, David published an article.Safety of N,N-Diethylacetamide The title of the article was Theoretical Infrared Spectra: Quantitative Similarity Measures and Force Fields. And the article contained the following:

IR spectroscopy can provide significant insight into the structures and dynamics of mols. of all sizes. The information that is contained in the spectrum is, however, often not easily extracted without the aid of theor. calculations or simulations. We present here the calculation of the IR spectra of a database of 703 gas phase compounds with four different force fields (CGenFF, GAFF-BCC, GAFF-ESP, and OPLS) using normal-mode anal. Modern force fields increasingly use virtual sites to describe, e.g., lone-pair electrons or the 蟽-holes on halogen atoms. This requires some adaptation of code to perform normal-mode anal. of such compounds,the implementation of which into the GROMACS software is briefly described as well. For the quant. comparison of the obtained spectra with exptl. reference data, we discuss the application of two different statistical correlation coefficients, Pearson and Spearman. The advantages and drawbacks of the different methods of comparison are discussed, and we find that both methods of comparison give the same overall picture, showing that present force field methods cannot match the performance of quantum chem. methods for the calculation of IR spectra. The experimental process involved the reaction of N,N-Diethylacetamide(cas: 685-91-6).Safety of N,N-Diethylacetamide

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Bawar, Khirsten Marie et al. published their research in Asian Journal of Biological and Life Sciences in 2021 |CAS: 102-07-8

The Article related to waterborne pathogen quorum sensing inhibitor, Placeholder for records without volume info and other aspects.COA of Formula: C13H12N2O

Bawar, Khirsten Marie; Cruz, Leannie Praise; Ilao, Kristine Bernadette; Justiniano, Julianne Mica; Panganiban, Lara Mae; Fabito, Diane Laine; Amayun, Christine Joy; Nas, John Sylvester published an article in 2021, the title of the article was In silico identification of novel compounds as quorum-sensing inhibitors in selected waterborne pathogens.COA of Formula: C13H12N2O And the article contains the following content:

Quorum sensing (QS) is a process involved in producing, detecting, responding, and releasing signaling mols. to maintain physiol. activities of most utilized by both gram-pos. and gram-neg. bacteria in various environmental conditions. This study aims to identify novel compounds that have potential QS inhibitory mechanisms against the gram-pos. bacteria Staphylococcus aureus (S. aureus) and Streptococcus pneumoniae (S. pneumoniae), and the gram-neg. bacteria Salmonella typhi (S. typhi) and Escherichia coli (E. coli). Compounds that are structurally similar to the known QS inhibitors were identified using ligand-based screening. Candidate compounds with 40 to 80% similarity with the known QS inhibitors were further evaluated through mol. docking with the QS-associated enzymes, namely ComA, ComE, LsrF, LsrK, AgrC, AgrA, LsrB, and Hfq. The binding affinity was visualized to identify the different non-covalent binding interactions. Compounds with <-8.0 kcal/mol docking score were considered for evaluation for their distribution coefficient (LogD) at different optimal growth of the bacteria, such as pH 4, 6, 7.4, 7.8, 8, and 9. Out of the 63 compounds evaluated, only three compounds demonstrated a high binding affinity, namely 1-phenyl-3-[5-(phenylcarbamoylamino)naphthalen-1-yl]urea and 1-naphthalen1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea with ComE of S. pneumoniae and 3-[(4-Methylphenyl)sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one to AgrA of S. aureus. Their high binding affinity may be attributed to the numerous hydrogen bonds and hydrophobic interactions. However, only 3-[(4-Methylphenyl)sulfonyl][1,2,3]triazolo[1,5-a]quinazolin-5(4H)-one has comparable LogD value with its QS inhibitor of AgrA, savarin, at the optimal growth pH for S. aureus. These findings suggest that the use of 3-[(4-Methylphenyl)sulfonyl][1,2,3]triazolo[1,5-a] quinazolin-5(4H)-one may be effective in controlling S. aureus growth probably through inhibition of AgrA. However, further studies are needed to confirm these findings. The experimental process involved the reaction of 1,3-Diphenylurea(cas: 102-07-8).COA of Formula: C13H12N2O

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Li, Xiaoqin et al. published their research in International Journal of Food Properties in 2021 |CAS: 144-80-9

The Article related to veterinary drug residue mass spectrum library, Placeholder for records without volume info and other aspects.Reference of N-((4-Aminophenyl)sulfonyl)acetamide

Li, Xiaoqin; Fang, Zhijuan; He, Xinye; Zhang, Shuqin; Ding, Hongliu; Ye, Hu published an article in 2021, the title of the article was Optimization of 204 veterinary drug residues method and establishing their mass spectrum library.Reference of N-((4-Aminophenyl)sulfonyl)acetamide And the article contains the following content:

A multi-class multi-residue anal. method was validated in this paper for simultaneously identifying 204 veterinary drugs in pork by UPLC-QTRAP MS/MS, including sulfonamides, quinolones, 尾-agonists, and nitroimidazoles. MRM-IDA-EPI mode of QTRAP was used to establish a secondary mass spectrum library of these 204 veterinary drugs, which could enhance the qual. anal. of suspect substances. The separation of substances was performed on a C18 column, with a gradient elution of 0.1% formic acid solution in water and methanol. Electrospray ionization (ESI), fast polarity switching, and scheduled MRM mode were used to collect the characterization results. Factors that affected the recovery were delicately optimized, such as solvent proportion, formic acid content, and purification method. We finally determined the extracting method with formic acid-acetonitrile-water (0.1:90:10, v:v:v) and purifying method with Cleanert LipoNo as a package for dispersive solid-phase extraction Matrix effects on the quant. results were also investigated. Some compounds had strong matrix inhibition or enhancement, and the matrix matching external standard method was used to quantify the compounds accurately. The correlation coefficient R2 was over 0.99 within the calibration linearity range for the detected 204 veterinary drugs. The limit of quantification (LOQ) was 0.5 鈭?5 渭g/kg. The recoveries ranged from 61.4% to 118.8% with RSDs of 3.1% to 19.2% (n = 6). The experimental process involved the reaction of N-((4-Aminophenyl)sulfonyl)acetamide(cas: 144-80-9).Reference of N-((4-Aminophenyl)sulfonyl)acetamide

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Kuznetsova, Ksenia G. et al. published their research in Journal of Proteomics in 2021 |CAS: 79-07-2

The Article related to cysteine alkylation methionine shotgun proteomics, Placeholder for records without volume info and other aspects.Category: amides-buliding-blocks

On January 16, 2021, Kuznetsova, Ksenia G.; Levitsky, Lev I.; Pyatnitskiy, Mikhail A.; Ilina, Irina Y.; Bubis, Julia A.; Solovyeva, Elizaveta M.; Zgoda, Victor G.; Gorshkov, Mikhail V.; Moshkovskii, Sergei A. published an article.Category: amides-buliding-blocks The title of the article was Cysteine alkylation methods in shotgun proteomics and their possible effects on methionine residues. And the article contained the following:

In order to optimize sample preparation for shotgun proteomics, we compared four cysteine alkylating agents: iodoacetamide, chloroacetamide, 4-vinylpyridine and Me methanethiosulfonate, and estimated their effects on the results of proteome anal. Because alkylation may result in methionine modification in vitro, proteomics data were searched for methionine to isothreonine conversions, which may mimic genomic methionine to threonine substitutions found in proteogenomic analyses. We found that chloroacetamide was superior to the other reagents in terms of the number of identified peptides and undesirable off-site reactions. Among the reagents evaluated, iodoacetamide increased the rate of methionine-to-isothreonine conversion, especially if the sample was prepared in gel. The presence of proline following methionine in a protein sequence increased the modification rate as well. Generally, the methionine-to-isothreonine conversion events were relatively rare, but should be taken into account in proteogenomic studies when searching for single nucleotide polymorphism events at the protein level. Addnl., we have evaluated other methionine modifications, such as oxidation and carbamidomethylation. We found that carbamidomethylation may affect up to 80% of peptides containing methionine under the condition of iodoacetamide alkylation. In this case, carbamidomethylation of methionine is more common than oxidation and should be accounted for as a variable modification during proteomic search. One of the most trending questions in bottom-up proteomics is the depth of proteome profiling, in other words, the coverage of proteins by identified tryptic peptides. In proteogenomics, where the identification of a single peptide, e.g. bearing an amino acid substitution, may be of interest, high sequence coverage is especially important. Chem. modifications during sample preparation may mimic biol. significant coding mutations at the proteome level. A typical example of such modification is methionine to isothreonine conversion during alkylation, which mimics methionine to threonine substitution in protein sequences due to resp. genomic mutations. Therefore, the studies on the proper selection of alkylating reagents which balance the cysteine alkylation efficiency and the extent of methionine conversion upon conventional proteomic sample preparation workflow are crucial for the outcome of proteogenomic analyses and should present a general interest for the proteomic community. The experimental process involved the reaction of 2-Chloroacetamide(cas: 79-07-2).Category: amides-buliding-blocks

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Borowiecki, Pawel et al. published their research in RSC Advances in 2022 |CAS: 5455-98-1

The Article related to adrenergic betha blocker one pot two step procedure, Placeholder for records without volume info and other aspects.Application In Synthesis of 2-(Oxiran-2-ylmethyl)isoindoline-1,3-dione

Borowiecki, Pawel; Zdun, Beata; Popow, Natalia; Wiklinska, Magdalena; Reiter, Tamara; Kroutil, Wolfgang published an article in 2022, the title of the article was Development of a novel chemoenzymatic route to enantiomerically enriched 尾-adrenolytic agents. A case study toward propranolol, alprenolol, pindolol, carazolol, moprolol, and metoprolol.Application In Synthesis of 2-(Oxiran-2-ylmethyl)isoindoline-1,3-dione And the article contains the following content:

Efficient chemoenzymic routes toward the synthesis of both enantiomers of adrenergic beta-blockers were accomplished by identifying a central chiral building block, which was first prepared using lipase-catalyzed kinetic resolution (KR, Amano PS-IM) as the asym. step at a five gram-scale (209 mM concentrate). The enantiopure (R)-chlorohydrin (>99% ee) subsequently obtained was used for the synthesis of a series of model (R)-(+)-beta-blockers (i.e., propranolol, alprenolol, pindolol, carazolol, moprolol, and metoprolol), which were produced with enantiomeric excess in the range of 96-99.9%. The pharmaceutically relevant (S)-counterpart, taking propranolol as a model, was synthesized in excellent enantiomeric purity (99% ee) via acetolysis of the resp. enantiomerically pure (R)-mesylate by using cesium acetate and a catalytic amount of 18-Crown-6, followed by acidic hydrolysis of the formed (S)-acetate. Alternatively, asym. reduction of a prochiral ketone, namely 2-(3-chloro-2-oxopropyl)-1H-isoindole-1,3(2H)-dione, was performed using lyophilized E. coli cells harboring overexpressed recombinant alc. dehydrogenase from Lactobacillus kefir (E. coli/Lk-ADH-Lica) giving the corresponding chlorohydrin with >99% ee. Setting the stereocenter early in the synthesis and performing a 4-step reaction sequence in a 鈥瞣ne-pot two-step鈥?procedure allowed the design of a 鈥瞫tep-economic鈥?route with a potential dramatic improvement in process efficiency. The synthetic method can serve for the preparation of a broad scope of enantiomerically enriched beta-blockers, the chem. structures of which rely on the common 伪-hydroxy-N-isopropylamine moiety, and in this sense, might be industrially attractive. The experimental process involved the reaction of 2-(Oxiran-2-ylmethyl)isoindoline-1,3-dione(cas: 5455-98-1).Application In Synthesis of 2-(Oxiran-2-ylmethyl)isoindoline-1,3-dione

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Threlfall, T. et al. published their research in Vibrational Spectroscopy in 2022 |CAS: 79-07-2

The Article related to primary carboxamide stretching vibration ir spectra, Placeholder for records without volume info and other aspects.Related Products of 79-07-2

On July 31, 2022, Threlfall, T. published an article.Related Products of 79-07-2 The title of the article was The infrared spectra of amides. Part 1. The stretching vibrations of primary carboxamides. And the article contained the following:

The IR spectra of more than 150 primarycarboxamides in the NH stretching and the carbonyl region have been measured. Comparison is made with Bellamys anal. of the stretching modes of amines. The offset to higher frequencies of amides compared with amines is attributed to the widening of the bond angle. The sym. and antisym. stretching of the NH2 bonds is analyzed via a rearrangement of the Linnett equations. It is shown thereby that changes of bond strength vary the sym. and antisym. frequencies approx. proportionately while deviations from that relationship are due either to changes of the bond angle, steric hindrance or to hydrogen bonding. The spectral changes of m- and p-substituted amides are correlated with Hammett sigma functions, both in the carbonyl and the NH2 stretching region. Intensities and the influence of steric effects are also discussed. The experimental process involved the reaction of 2-Chloroacetamide(cas: 79-07-2).Related Products of 79-07-2

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Hussein, Ag et al. published their research in Austin Journal of Analytical and Pharmaceutical Chemistry in 2021 |CAS: 144-80-9

The Article related to ulcer index inflammation benzimidazole antiinflammatory, Placeholder for records without volume info and other aspects.Related Products of 144-80-9

Hussein, Ag; Sakr, Hm; Mansour, Am; Ayyad, Rr published an article in 2021, the title of the article was Ulcer index and anti-inflammatory testing of some benzimidazole derivatives.Related Products of 144-80-9 And the article contains the following content:

In this work, we carry out the testing of some Benzimidazole derivatives as anti-inflammatory using Indomethacin 10mg/Kg, diclofenac sodium 7mg/Kg, celecoxib 100mg/Kg and tested compounds of 200mg/Kg. The tested compounds showed anti-inflammatory activity in comparison with the standard reference drugs. In addnl., carrying out the testing of ulcer index for some testing compounds 600mg/Kg comparing with indomethacin 100mg/Kg, the testing revealed indomethacin causes ulcer in stomach of the testing animals, while the testing compounds no ulcerated the stomach of the testing animal. The experimental process involved the reaction of N-((4-Aminophenyl)sulfonyl)acetamide(cas: 144-80-9).Related Products of 144-80-9

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Karpun, Yevhen et al. published their research in Pharmacia (Sofia, Bulgaria) in 2021 |CAS: 79-07-2

The Article related to antimicrobial activity bistriazole thione microorganism, Placeholder for records without volume info and other aspects.Related Products of 79-07-2

Karpun, Yevhen; Parchenko, Volodymyr; Fotina, Tetiana; Demianenko, Denys; Fotin, Anatolii; Nahornyi, Volodymyr; Nahorna, Natalia published an article in 2021, the title of the article was The investigation of antimicrobial activity of some s-substituted bis-1,2,4-triazole-3-thiones.Related Products of 79-07-2 And the article contains the following content:

New S-substituted 4-alkyl-(5-((3-(pyridin-4-yl)-1H-1,2,4-triazole-5-yl)thio)methyl)-4H-1,2,4-triazole-3-thiol derivatives have been designed, synthesized and studied their antimicrobial activity on 11 standard Gram-pos. and Gram-neg. microorganism strains. Their spectral and physicochem. parameters were established using modern comprehensive methods of anal., including 1H NMR spectroscopy, GC-MS and elemental anal.It has been found that compound 2a exhibits strong suppression of 5 test strains (MBC = 15.6 渭g/mL). Compound 4a showed moderate inhibition of Salmonella pullorum, Escherichia coli O2 , Salmonella enteritidis strains (MBC = 31.25 渭g/mL) Compound 6a was sensitive toward ten tested bacteria at 31.25渭g/mL concentration The experimental process involved the reaction of 2-Chloroacetamide(cas: 79-07-2).Related Products of 79-07-2

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