4.3 Article

Facile synthesis, spectroscopic evaluation and antimicrobial screening of metal endowed triazole compounds

期刊

BIOMETALS
卷 34, 期 6, 页码 1329-1351

出版社

SPRINGER
DOI: 10.1007/s10534-021-00345-6

关键词

Triazole Schiff base; DFT theory; Thermal stability; Fluorescence properties; Antioxidant activity

资金

  1. Higher Education Commission (HEC) of Pakistan through the NRPU Project [7800]
  2. King Khalid University Saudi Arabia [R.G.P. 2/3/42]

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This study presents the synthesis, structural characterization and biological evaluation of a new triazole Schiff base ligand and its corresponding complexes. The compounds showed promising antibacterial, antifungal and antioxidant activities, indicating their potential as chemical scaffolds in the future against microbial infections.
The scientific interest in developing new complexes as inhibitors of bacterial biofilm related infections is constantly rising. The present work describes the chemical synthesis, structural and biological scrutiny of a triazole Schiff base ligand and its corresponding complexes. Triazole Schiff base, (2-methoxy-4-[(1H-1,2,4-triazol-3-ylimino)methyl]phenol) was synthesized from the condensation reaction of 3-amino-1,2,4-triazole and 4-hydroxy-3-methoxybenzaldehyde in an equimolar ratio. The triazole ligand (H2L) was characterized by physical (solubility, color, melting point), spectroscopic [UV-visible (UV-Vis), Fourier transform infrared spectroscopy (FT-IR), proton nuclear magnetic resonance (H-1-NMR) and mass spectra (MS)] and micro analysis to evaluate their elemental composition. The bidentate ligand was complexed with transition metal [VO(IV), Fe(II), Co(II), Ni(II), Cu(II) and Zn(II)] in 1:2 molar ratio. The complexes were characterized by physical (color, solubility, decomposition temperature, conductance and magnetic moment), FT-IR, UV-Vis and elemental analysis. Thermal stability and fluorescence properties of the compounds were also determined. Density functional theory based theoretical calculations were accomplished to gain more insight into spectroscopic properties. The frontier molecular orbital analysis revealed that the ligand was less reactive with reduced electron donating capability and more kinetic stability than complexes. The as-synthesized compounds were scrutinized for anti-bacterial and anti-fungal activity against selected strains. Cobalt complex exhibited highest antibacterial activity against Escherichia coli and nickel complex has shown highest antifungal activity against Aspergillus niger. All the compounds also showed good antioxidant activity. The theoretical results reflect consistency with the experimental findings signifying that such compounds could be the promising chemical scaffolds in the near future against microbial infectious.

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