Crystal structure, Hirshfeld surface analysis and DFT studies of 5-(adamantan-1-yl)-3-[(4-chlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazole, a potential 11β-HSD1 inhibitor

5-(Adamantan-1-yl)-3-[(4-chlorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazole (4) was identified as a potential 11β-hydroxysteroid dehydrogenase type 1 (11β-HSD1) inhibitor and this paper describes the in-depth structural analysis thereof. Compound 4 was synthesized in a 92% yield and its 3D-structure...

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Detalles Bibliográficos
Autores principales: Al-Wahaibi, Lamya H., Joubert, Jacques, Blacque, Olivier, Al-Shaalan, Nora H., El-Emam, Ali A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6930263/
https://www.ncbi.nlm.nih.gov/pubmed/31875009
http://dx.doi.org/10.1038/s41598-019-56331-z

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6930263/
https://www.ncbi.nlm.nih.gov/pubmed/31875009
http://dx.doi.org/10.1038/s41598-019-56331-z

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