@article{460296b890e94a9e876b9d664f1ae22a,
title = "Coupling of acceptor-substituted diazo compounds and tertiary thioamides: synthesis of enamino carbonyl compounds and their pharmacological evaluation",
abstract = "This paper describes the synthesis of enamino carbonyl compounds by the copper(i)-catalyzed coupling of acceptor-substituted diazo compounds and tertiary thioamides. We plan to use this method to synthesize indolizidine (−)-237D analogs to find α6-selective antismoking agents. Therefore, we also performed in silico α6-nAchRs binding studies of selected products. Compounds with low root-mean-square deviation values showed more favorable binding free energies. We also report preliminary pharmacokinetic data on indolizidine (−)-237D and found it to have weak activity at CYP3A4. In addition, as enamino carbonyl compounds are also known for antimicrobial properties, we screened previously reported and new enamino carbonyl compounds for antibacterial, antimicrobial, and antifungal properties. Eleven compounds showed significant antimicrobial activities.",
author = "Jim Secka and Arpan Pal and Acquah, {Francis A.} and Mooers, {Blaine H.M.} and Karki, {Anand B.} and Dania Mahjoub and Fakhr, {Mohamed K.} and Wallace, {David R.} and Takuya Okada and Naoki Toyooka and Adama Kuta and Naga Koduri and Deacon Herndon and Roberts, {Kenneth P.} and Zhiguo Wang and Bethany Hileman and Nisha Rajagopal and Hussaini, {Syed R.}",
note = "Funding Information: This research was funded through the award HR-18-049 from the Oklahoma Center for the Advancement of Science and Technology. This material is based upon work supported by the National Science Foundation under grant no. CHE-104874. The molecular simulations were supported by OCAST grant HR20-002 and NIH grants RO1 CA242845, P21 GM103640, P 30 CA225520 and were done using the computing resources of the Laboratory of Biomolecular Structure and Function and the Oklahoma State University High Performance Computing Center, which is supported by NSF OAC-1126330. Publisher Copyright: {\textcopyright} 2022 The Royal Society of Chemistry.",
year = "2022",
month = jul,
day = "5",
doi = "10.1039/d2ra02415b",
language = "English",
volume = "12",
pages = "19431--19444",
journal = "RSC Advances",
issn = "2046-2069",
publisher = "Royal Society of Chemistry",
number = "30",
}