1. Synthesis, characterization, <italic>in vitro</italic> and <italic>in silico</italic> biological studies of 3d transition metal(II) chelates of a Schiff base derived from sulfamethazine and 3,5-diiodosalicylaldehyde.
- Author
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Saeed, Muhammad, Parveen, Bushra, Rasool, Nasir, Ghulam Ali, Kulsoom, and Munawar, Khurram Shahzad
- Subjects
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LIGANDS (Chemistry) , *METAL complexes , *COPPER , *TRANSITION metals , *MAGNETIC moments - Abstract
AbstractA Schiff base (imine) ligand, (E)-4-((2-hydroxy-3,5-diiodobenzylidene)amino)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide (HL), was synthesized by condensation of 3,5-diiodosalicylaldehyde with sulfamethazine. The ligand was then complexed with Zn(II), Cu(II), Ni(II), Co(II) and Fe(II) employing a metal to ligand ratio of 1:2 to form chelates (
1 -5 ), [M(L)2(H2O)2]. Characterization was done by UV-visible, FTIR, 1H and 13C NMR spectroscopy, elemental analysis, magnetic moments, thermogravimetric analyses (TGA) and conductance studies. The Schiff base behaved as a bidentate ligand and metal chelates assumed octahedral geometry. MOE-docking was employed to assess binding of the Schiff base (HL) and its chelates (1 -5 ) with 1T2P, 1VVQ, 2W61, 3U2D, 4H8E and 5K18 proteins. Results indicated that Zn(II) chelate (1 ) and Fe(II) chelate (5 ) are the most potent compounds. Antibacterial and antibiofilm activities were executed againstEnterococcus faecalis ,Staphylococcus aureus ,Proteus mirabilis andKlebsiella pneumoniae . Antifungal activities were performed againstCandida albicans andAspergillus niger . The Schiff base exhibited moderate antibacterial/antifungal activities that were enhanced on chelation with metal ions. Zinc(II) chelate (1 ) and Fe(II) chelate (5 ) show excellent antibacterial/antifungal activities. Complex2 exhibited good antibiofilm activity. [ABSTRACT FROM AUTHOR]- Published
- 2024
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