Synthesis, biological evaluation, and In silico molecular docking of N‐(4‐(4‐substitutedphenyl)‐6‐(substituted aryl) pyrimidin‐2‐yl)‐2‐(2‐isonicotinoyl hydrazinyl) acetamide

Isonicotinohydrazide is the first‐line medication in the prevention and treatment of tuberculosis. Antitubercular, antibacterial, antifungal, antiviral, anti‐inflammatory, antimalarial activity, anticancer, antineoplastic activity, and anti‐HIV activity are all demonstrated by drugs with a pyrimidin...

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Published in:Journal of biochemical and molecular toxicology 2024-01, Vol.38 (1), p.e23634-n/a
Main Authors: Soni, Hetal I., Patel, Navin B., Ahmad, Iqrar, Patel, Harun, Rivera, Gildardo
Format: Article
Language:English
Subjects:
Acetamides
Anti-Bacterial Agents - pharmacology
Anticancer properties
antimalarial
Antimalarial activity
Antimalarials
antiprotozoa
Antitubercular Agents - pharmacology
antitubercular H37RV
Antiviral agents
Aromatic compounds
Chemical synthesis
Fungicides
HIV
Human immunodeficiency virus
Inflammation
Isoniazid
isonicotinohydrazide
Mass spectroscopy
Microbial Sensitivity Tests
Molecular docking
Molecular Docking Simulation
NMR
Nuclear magnetic resonance
pyrimidine
Pyrimidines
Pyrimidines - chemistry
Structure-Activity Relationship
Substitutes
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Summary:Isonicotinohydrazide is the first‐line medication in the prevention and treatment of tuberculosis. Antitubercular, antibacterial, antifungal, antiviral, anti‐inflammatory, antimalarial activity, anticancer, antineoplastic activity, and anti‐HIV activity are all demonstrated by drugs with a pyrimidine ring. The current study focuses on the synthesis of N‐(4‐(substituted‐phenyl)‐6‐(substituted‐aryl) pyrimidin‐2‐yl)‐2‐(2‐isonicotinoylhydrazinyl) acetamide from isonicotinohydrazide. Newly synthesized compounds were characterized by spectral studies (IR, 1H‐NMR, 13C‐NMR, and mass spectroscopy). They were screened for their antituberculosis, antimalarial, and antiprotozoal activities and compared with standard drugs. Molecular docking of isonicotinohydrazide‐bearing pyrimidine motifs was also done for some of the active compounds. In silico molecular docking, synthesis, and biological evaluation of pyrimidine‐based isonicotinohydrazide.
ISSN:1095-6670
1099-0461
DOI:10.1002/jbt.23634