img
img
An experimental and computational studies, evaluating the in vitro antidiabetic and antioxidant activity, in silico prediction ADMET properties of 5‐chloro‐1H‐benzimidazole and its newly synthesized silver(I) complex   
Yazarlar (4)
Ceyhun Küçük
Zonguldak Bülent Ecevit Üniversitesi, Türkiye
Doç. Dr. Sibel ÇELİK Doç. Dr. Sibel ÇELİK
Kırşehir Ahi Evran Üniversitesi, Türkiye
Şenay Yurdakul
Türkiye
Dr. Öğr. Üyesi Ebru ÇÖTELİ Dr. Öğr. Üyesi Ebru ÇÖTELİ
Kırşehir Ahi Evran Üniversitesi, Türkiye
Devamını Göster
Özet
In this research, a new Ag(I) complex, namely, [Ag(5-chloro-1H-benzimidazole)2(NO3)], has been synthesized using the benzimidazole-based ligand 5-chloro-1H-benzimidazole (5ClBZ). Ag(I) complexes were characterized by elemental analysis, UV-Vis, FT-IR, and 1H NMR spectroscopy, and DFT analysis was used. The free ligand and its Ag(I) complexes were tried for their biochemical properties, including antioxidant and antidiabetic properties. To study the molecular structures of the title compounds, in silico ADME/Tox research was performed on the newly made complex and free ligand. The empirical guidelines relating to ADME were utilized to conduct molecular docking simulations and in-depth drug-likeness profiling. This was carried out to validate the conclusions and identify exact binding interactions. Based on the study's findings, it has been determined that these new compounds have significant potential as powerful therapeutic agents for controlling antioxidant and antidiabetic activities.
In this research, a new Ag(I) complex, namely, [Ag(5-Chlorobenzimidazole)2NO3], has been synthesized and characterized by elemental analysis, IR, UV-Vis, and 1H NMR spectroscopy. The electronic behavior of the compounds were investigated with DFT method. Also, antioxidant and antidiabetic properties of the ligand and its Ag(I) complex were investigated. image
Anahtar Kelimeler
5-chloro-1H-benzimidazole | ADME | antidiabetic | antioxidant | DFT | molecular docking
Makale Türü Özgün Makale
Makale Alt Türü SSCI, AHCI, SCI, SCI-Exp dergilerinde yayımlanan tam makale
Dergi Adı Applied Organometallic Chemistry
Dergi ISSN 0268-2605
Dergi Tarandığı Indeksler SCI-Expanded
Dergi Grubu Q2
Makale Dili Türkçe
Basım Tarihi 04-2024
Cilt No 38
Sayı 6
Doi Numarası 10.1002/aoc.7499
Makale Linki http://dx.doi.org/10.1002/aoc.7499