Cargando…
5-((1H-imidazol-1-yl)methyl)quinolin-8-ol as potential antiviral SARS-CoV-2 candidate: Synthesis, crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies
A potential new drug to treat SARS-CoV-2 infections and chloroquine analogue, 5-((1H-imidazol-1-yl)methyl)quinolin-8-ol (DD1) has been here synthesized and characterized by FT-IR, (1)H-NMR, (13)C-NMR, ultraviolet-visible, ESI-MS and single-crystal X-ray diffraction. DD1 was optimized in gas phase, a...
Autores principales: | Douche, Dhaybia, Sert, Yusuf, Brandán, Silvia A., Kawther, Ameed Ahmed, Bilmez, Bayram, Dege, Necmi, Louzi, Ahmed El, Bougrin, Khalid, Karrouchi, Khalid, Himmi, Banacer |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Elsevier B.V.
2021
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7839438/ https://www.ncbi.nlm.nih.gov/pubmed/33526951 http://dx.doi.org/10.1016/j.molstruc.2021.130005 |
Ejemplares similares
-
Crystal structure and Hirshfeld surface analysis of hexyl 1-hexyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
por: Bouzian, Younos, et al.
Publicado: (2020) -
Crystal structure, Hirshfeld surface analysis, DFT and molecular docking investigation of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl 2-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]quinoline-4-carboxylate
por: Bouzian, Younos, et al.
Publicado: (2021) -
Crystal structure, Hirshfeld surface analysis and DFT studies of 2-[5-(4-methylbenzyl)-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl]acetic acid
por: Daoui, Said, et al.
Publicado: (2019) -
Crystal structure, Hirshfeld surface analysis and DFT studies of 6-[(E)-2-(thiophen-2-yl)ethenyl]-4,5-dihydropyridazin-3(2H)-one
por: Daoui, Said, et al.
Publicado: (2019) -
Crystal structure and DFT study of benzyl 1-benzyl-2-oxo-1,2-dihydroquinoline-4-carboxylate
por: Bouzian, Younos, et al.
Publicado: (2019)