TY - JOUR
T1 - Synthesis, Characterization, Molecular Docking, and In Vitro Biological Activities of Schiff Base Metal Complexes With Furan Moiety
AU - Nayab, Saira
AU - Jan, Kalsoom
AU - Khan, Waliullha
AU - Subhan, Amjad
AU - Nguyen, Nhi Thi Xuan
AU - Son, Younghu
AU - Yoon, Minyoung
AU - Lee, Hyosun
N1 - Publisher Copyright:
© 2025 John Wiley & Sons Ltd.
PY - 2025/4
Y1 - 2025/4
N2 - Herein, Cu(II), Zn(II), and Cd(II) complexes with furan-derived Schiff base ligand, (E)-N1,N1-diethyl-N2-(furan-2-ylmethylene)ethane-1,2-diamine(DEF), were synthesized. The synthesized ligand and M(II) (M = Cu, Zn, and Cd) complexes were characterized to confirm their purity and successful synthesis using 1H NMR, 13C NMR, and FTIR spectroscopy. Thermal analysis demonstrated their stability, whereas UV-Vis spectroscopy and molar conductance studies provided insights into their electronic properties and coordination behavior. Additionally, X-ray diffraction studies indicated that the Zn(II) and Cd(II) complexes have distorted tetrahedral geometries, whereas the Cu(II) complex adopted distorted square planar geometry. The studied complexes showed remarkable free-radical scavenging activity. Furthermore, they exhibited good inhibitory activity against urease and α-amylose. In particular, [Cu(DEF)Cl2] showed the best antioxidant activity, with an IC50 of 3.21 ± 0.19 μM, and the highest α-amylose inhibitory activities, with an IC50 of 6.11 ± 0.33 μM. Moreover, [Cd(DEF)Br2] proved to be more potent against Jack bean and Bacillus pasteurii ureases, with IC50 values of 3.90 ± 0.11 μM and 6.01 ± 0.10 μM, respectively. Molecular docking studies showed a good correlation between the biological activities of the synthesized [M(DEF)X2] complexes. Thus, the proposed compounds can serve as promising candidates for the treatment of infectious diseases.
AB - Herein, Cu(II), Zn(II), and Cd(II) complexes with furan-derived Schiff base ligand, (E)-N1,N1-diethyl-N2-(furan-2-ylmethylene)ethane-1,2-diamine(DEF), were synthesized. The synthesized ligand and M(II) (M = Cu, Zn, and Cd) complexes were characterized to confirm their purity and successful synthesis using 1H NMR, 13C NMR, and FTIR spectroscopy. Thermal analysis demonstrated their stability, whereas UV-Vis spectroscopy and molar conductance studies provided insights into their electronic properties and coordination behavior. Additionally, X-ray diffraction studies indicated that the Zn(II) and Cd(II) complexes have distorted tetrahedral geometries, whereas the Cu(II) complex adopted distorted square planar geometry. The studied complexes showed remarkable free-radical scavenging activity. Furthermore, they exhibited good inhibitory activity against urease and α-amylose. In particular, [Cu(DEF)Cl2] showed the best antioxidant activity, with an IC50 of 3.21 ± 0.19 μM, and the highest α-amylose inhibitory activities, with an IC50 of 6.11 ± 0.33 μM. Moreover, [Cd(DEF)Br2] proved to be more potent against Jack bean and Bacillus pasteurii ureases, with IC50 values of 3.90 ± 0.11 μM and 6.01 ± 0.10 μM, respectively. Molecular docking studies showed a good correlation between the biological activities of the synthesized [M(DEF)X2] complexes. Thus, the proposed compounds can serve as promising candidates for the treatment of infectious diseases.
KW - X-ray structures
KW - antioxidant
KW - furan-derived ligand
KW - molecular docking
KW - urease inhibition
KW - α-amylase
UR - https://www.scopus.com/pages/publications/105000424283
U2 - 10.1002/aoc.70116
DO - 10.1002/aoc.70116
M3 - Article
AN - SCOPUS:105000424283
SN - 0268-2605
VL - 39
JO - Applied Organometallic Chemistry
JF - Applied Organometallic Chemistry
IS - 4
M1 - e70116
ER -