Synthesis, Biological Evaluation and Molecular Docking Study of Pyrazole, Pyrazoline Clubbed Pyridine as Potential Antimicrobial Agents

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Author(s): Nisheeth C Desai*, Darshita V Vaja, Krunalsinh A. Jadeja, Surbhi B. Joshi, Vijay M Khedkar.

Journal Name: Anti-Infective Agents
Anti-Infective Agents in Medicinal Chemistry

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Abstract:

Introduction: In continuation of our efforts to find new antimicrobials, herein we report the synthesis of various pyrazole, pyrazoline, and pyridine based novel bioactive heterocycles (3a-t).

Methods: Newly synthesized compounds were analysed for their antimicrobial activity. Compounds 3c, 3h, 3i, 3k, 3n, and 3q showed significant antimicrobial activity. Molecular docking study for the most active analogues against DNA gyrase subunit b (PDB ID: 1KZN) corroborated well with the observed antimicrobial potency exhibiting significant binding affinity.

Results: Interpretation of the chemical structures reported in this paper was based on IR, 1H NMR, 13C NMR, and mass spectral data.

Keywords: Pyrazole, pyrazoline, pyridine, heterocycles, antimicrobial activity, Molecular docking

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(E-pub Ahead of Print)
DOI: 10.2174/2211352517666190627144315