Synthesis, characterization, biological and molecular docking assessment of computationally bioactive 1,3-thiazolidin-4-one derivatives bearing indole and bi-pyrimidine moieties

被引：5

作者：

Arshad, Mohammad ^{[1
]}

Khan, Mohd Shoeb ^{[2
]}

Nami, Shahab A. A. ^{[3
]}

机构：

[1] Shaqra Univ, Coll Med, Dept Basic Sci, Al Dawadmi 11911, Saudi Arabia

[2] Aligarh Muslim Univ Aligarh, Interdisciplinary Nanotechnol Ctr, Aligarh, Uttar Pradesh, India

[3] Aligarh Muslim Univ Aligarh, Dept Chem, Fac Sci, Aligarh, Uttar Pradesh, India

来源：

JOURNAL OF THE IRANIAN CHEMICAL SOCIETY | 2021年 / 18卷 / 09期

关键词：

1,3-thiazolidin-4-one; Synthesis; Characterization; Biological screening; Molecular docking; DESIGN; THIAZOLIDIN-4-ONE; ANTIBACTERIAL; ANTIOXIDANT; AGENTS; MTT;

D O I：

10.1007/s13738-021-02200-4

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

1,3-Thiazolidin-4-one derivatives bearing indole and bi-pyrimidine nucleuses (1-12) was designed and analyzed computationally for bioactivity. The synthesized compounds were characterized using FTIR, NMR and Mass Spectroscopy. The compounds (1-12) were then assessed for antibacterial therapeutic effects against the microbes [S. aureus (ATCC-25923), S. epidermidis (ATCC-29887),E. coli (ATCC-25922), and P. mirabilis (ATCC-25933)] using disk diffusion methods. The percent viability of the cells was analyzed by MTT against HepG2 cells to observe the cytotoxicity. Additionally, the molecular docking was carried out for the compounds (1-12) against the receptor GlcN-6P to assess the extent of H-bonding and the binding affinities. [GRAPHICS] .

引用

页码：2397 / 2406

页数：10

共 47 条

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