Molecular Structure, Docking, Spectroscopic Characterization, Antibacterial, and Anticancer Activity of Copper(I, II), Silver(I), and Cadmium(II) Complexes

Applied Organometallic Chemistry, Journal Year: 2025, Volume and Issue: 39(2)

Published: Jan. 9, 2025

ABSTRACT Seven new complexes of [Cu(H 2 L) ]I.2H O (C1), L)(HL)]ClO 4 .2H (C2), Ag(H L)NO 3 (C3), Ag (H L)(OAc) (C4), Cd (HL)(OH) (C5), (HL)NO (C6), and (HL)Cl (C7) [N‐phenyl‐2‐(phenylglycyl)hydrazine‐1‐carbothioamide](H have been synthesized characterized by various techniques. All metal are mononuclear in nature, except complex [Ag ] which is binuclear. The (C5–C7) adopt tetrahedral, square planar geometry the copper (C1–C3). DFT calculation performed supports expected structures. Stability study C3 C7 alkaline, acidic, neutral pH through more than 24 h investigated. ligand its compounds were examined for their effectiveness against three different types bacterial strains: Gram negative ( Escherichia coli ) positive Streptococcus pyogenes Bacillus polymyxa ). findings demonstrated that complexes, comparison to ligand, exhibited effective antibacterial anticancer properties distinct human cancer cell lines: liver, breast, colon. Cu(I) (C1) greatest effect with lowest IC 50 value among investigated lines. theoretical molecular docking studies revealed active amino acids interact compounds.

Language: Английский

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Targeted Colon Cancer and Chemotherapeutic Through Metal Glycoconjugates: Design, Synthesis, Molecular Docking, and DFT Investigations

Applied Organometallic Chemistry, Journal Year: 2025, Volume and Issue: 39(3)

Published: Feb. 7, 2025

ABSTRACT To advance our study on the GLUT's glucose recognition binding site and enhance effectiveness of targeted anticancer compounds based encouraging findings, glycogenated metal complexes have shown promise in combating colon cancer (HCT‐116) through salicylaldehyde‐D‐glucosamine Schiff base(H 2 L), we proceed with research utilizing various cell lines different ions known for their potent effect. Newly synthesized formulae Zn (HL) , (CH 3 ) Sn(HL) [Ru(L)(HL)H O].H O are directed against two (HCT‐116 Caco‐2). Different characterization techniques used to confirm structures. DFT was structurally optimize compounds. The particle size distribution performed all chelates. All revealed remarkable activities especially ligand Ru (III) complex recording IC 50 values 21.73 μg/mL HCT‐116 49.53 Caco‐2 lines, respectively. results showed that can attract sugar‐conjugated efficiency its confirmed evaluation GSH, SOD, MDA, NO, LDH levels. high affinity glycoconjugates DNA explored using electrophoresis. Additionally, chelates significant antimicrobial activity. (II) bactericidal activity strain Helicobacter pylori . docking simulation explore active amino acids participate biological interaction.

Language: Английский

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Synthesis, Characterization, DFT, TEM, Anticancer, Antibacterial, and Electrical Properties Studies of Novel VO(II), Cu(II), Ru(III), and Ag(I) Complexes With Hydrazone Derivatives

Applied Organometallic Chemistry, Journal Year: 2025, Volume and Issue: 39(3)

Published: Feb. 24, 2025

ABSTRACT Four new VO(II), Cu(II), Ru(III), and Ag(I) chelates were created from the ligand, 2‐(phenylglycyl)‐N‐(p‐tolyl)hydrazine‐1‐carbothioamide(H 2 L). The structures of compounds investigated using analytical spectroscopic techniques supported by theoretical DFT study. In addition, all exhibited strong anticancer effects against liver (Hep‐G2), breast (MCF‐7), colon (HCT‐116) human cancer cell lines. VO(II) complex observed greatest activity with IC 50 reached to 14, 19, 20 μM Hep‐G2, MCF‐7, HCT‐116 lines, respectively. Molecular docking confirmed resulted results. Also, microbial growth inhibition S. pyogenes E. coli organisms. transmission electron microscope (TEM) demonstrated that pure ligand's particle size decreased when it formed complexes various metals. electrical examination involved measuring their conductivity dielectric characteristics explore application in devices.

Language: Английский

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Synthesis and characterization of MIL-88B(Fe) MOF for high-performance humidity sensing

Sensors and Actuators B Chemical, Journal Year: 2025, Volume and Issue: 438, P. 137806 - 137806

Published: April 16, 2025

Language: Английский

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