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- W4366993022 abstract "N-Heterocycles stand out in medicinal chemistry as significant pharmacophores because of their wide biological potential and structural diversity. In this perspective, we have synthesized a new series of isatin-semicarbazone linked acetamide triazole hybrids via CuAAC reaction with an aim of obtaining a series with tractable SAR and antimicrobial potencies better than the existing antimicrobial agents. All derivatives were structurally characterized using FT-IR, 1H NMR, 13C NMR, HRMS and tested their antimicrobial efficacy against various microbial species. Among the synthesized series compound 7d exhibited highest potency against E. coli with MIC of 0.0108 µmol/mL, while 6b displayed highest efficacy towards A. niger with MIC of 0.0072 µmol/mL. Further, in order to find out the interactions of synthesized triazoles within the active sites of 1KZN and 5TZ1, molecular docking was performed. Results of the molecular docking were found in agreement with the in vitro antimicrobial study results." @default.
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- W4366993022 date "2023-09-01" @default.
- W4366993022 modified "2023-09-25" @default.
- W4366993022 title "Isatin-semicarbazone linked acetamide 1,2,3-triazole hybrids: Synthesis, antimicrobial evaluation and docking simulations" @default.
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- W4366993022 doi "https://doi.org/10.1016/j.molstruc.2023.135660" @default.
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