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基于脂肪族酰肼的苯磺酰胺衍生物的合成、体外抗微生物分析和分子对接研究作为α-葡萄糖苷酶和脲酶的有效抑制剂。

Synthesis, In Vitro Anti-Microbial Analysis and Molecular Docking Study of Aliphatic Hydrazide-Based Benzene Sulphonamide Derivatives as Potent Inhibitors of α-Glucosidase and Urease.

机构信息

Department of Chemistry, Hazara University, Mansehra 21120, Pakistan.

Department of Chemistry, School of Natural Sciences (SNS), National University of Science and Technology (NUST), H-12, Islamabad 46000, Pakistan.

出版信息

Molecules. 2022 Oct 21;27(20):7129. doi: 10.3390/molecules27207129.

Abstract

A unique series of sulphonamide derivatives was attempted to be synthesized in this study using a new and effective method. All of the synthesized compounds were verified using several spectroscopic methods, including FTIR, H-NMR, C-NMR, and HREI-MS, and their binding interactions were studied using molecular docking. The enzymes urease and α-glucosidase were evaluated against each derivative (-). When compared to their respective standard drug such as acarbose and thiourea, almost all compounds were shown to have excellent activity. Among the screened series, analogs (IC = 3.20 ± 0.40 and 2.10 ± 0.10 µM) and (IC = 2.50 ± 0.40 and 5.30 ± 0.20 µM), emerged as potent molecules when compared to the standard drugs acarbose (IC = 8.24 ± 0.08 µM) and urease (IC = 7.80 ± 0.30). Moreover, an anti-microbial study also demonstrated that analogs and were found with minimum inhibitory concentrations (MICs) in the presence of standard drugs streptomycin and terinafine.

摘要

本研究尝试使用新的有效方法合成了一系列独特的磺胺衍生物。所有合成的化合物均通过几种光谱方法进行了验证,包括 FTIR、H-NMR、C-NMR 和 HREI-MS,并通过分子对接研究了它们的结合相互作用。用酶脲酶和α-葡萄糖苷酶对每个衍生物(-)进行了评估。与各自的标准药物(如阿卡波糖和硫脲)相比,几乎所有化合物都表现出优异的活性。在所筛选的系列中,类似物 (IC = 3.20 ± 0.40 和 2.10 ± 0.10 µM)和 (IC = 2.50 ± 0.40 和 5.30 ± 0.20 µM)与标准药物阿卡波糖(IC = 8.24 ± 0.08 µM)和脲酶(IC = 7.80 ± 0.30)相比,表现出更强的活性。此外,抗菌研究还表明,类似物 和 与标准药物链霉素和特比萘芬一起使用时,具有最低抑菌浓度(MIC)。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/8a25/9609496/b9cebf1fc1e4/molecules-27-07129-sch001.jpg

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