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Synthesis, Characterization, Antimicrobial Evaluation, and Computational Investigation of Substituted Imidazo[2,1‐b][1,3,4]Thiadiazole Derivatives    
Yazarlar
Dağlı Meltem
Karabük Üniversitesi, Türkiye
Mustafa Er
Türkiye
Tuncay Karakurt
Kırşehir Ahi Evran Üniversitesi
Abdurrahman Onaran
Akdeniz Üniversitesi, Türkiye
Hakan Alıcı
Türkiye
Hakan Tahtacı
Karabük Üniversitesi, Türkiye
Özet
In this study, a novel series of 2,6-disubstituted and 2,5,6-trisubstituted imidazo[2,1-b][1,3,4]thiadiazole derivatives were synthesized starting from 2-amino-1,3,4-thiadiazole derivatives. Structures of the synthesized compounds were characterized using various analysis techniques. Then, in vitro biological activity tests were carried out for all synthesized compounds and they were found to show moderate to good activity against all bacteria and fungi tested. Next, molecular docking simulations were performed to observe the inhibition effect of the synthesized compounds on the 3R9C receptor and support their biological activity results. Finally, the pharmacokinetic, ADME and toxicity properties of all compounds were examined using FAF-Drugs and ProTox webservers and it was concluded that they had acceptable toxicity and ADME properties.
Anahtar Kelimeler
Ab initio calculations | ADME | Biological activity | Imidazo[2 | 1-b][1 | 3 | 4]thiadiazole | Mannich bases
Makale Türü Özgün Makale
Makale Alt Türü SSCI, AHCI, SCI, SCI-Exp dergilerinde yayımlanan tam makale
Dergi Adı CHEMISTRYSELECT
Dergi ISSN 2365-6549
Dergi Tarandığı Indeksler SCI-Expanded
Dergi Grubu Q3
Makale Dili İngilizce
Basım Tarihi 10-2020
Cilt No 5
Sayı 38
Sayfalar 11753 / 11763
Doi Numarası 10.1002/slct.202002821
Makale Linki http://dx.doi.org/10.1002/slct.202002821