AC1NBYEX
2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl]sulfanyl]-N-(3,4-difluorophenyl)acetamide
Also Known As: KS-00003RQR|SS-0234|AM-807/41626680|2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl]sulfanyl]-N-(3,4-difluorophenyl)acetamide|2-{[3-cyano-4-(trifluoromethyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide|2-{[3-cyano-4-(trifluoromethyl)-5H,6H,7H,8H,9H,10H-cycloocta[b]pyridin-2-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
| Molecular Formula | C21H18F5N3OS |
|---|---|
| Molecular Weight | 455.10907 g/mol |
| LogP | 5.64008 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.10907 |
| Monoisotopic Mass | 455.10907 |
| Heavy Atoms | 31 |
| Complexity | 1033.1411 |
Chemical Identifiers
| CAS Number | 626228-75-9 |
|---|---|
| SMILES | C1CCCC2=C(CC1)C(=C(C(=N2)SCC(=O)NC3=CC(=C(C=C3)F)F)C#N)C(F)(F)F |
Product Overview
AC1NBYEX (CAS 626228-75-9), with molecular formula C21H18F5N3OS and molecular weight 455.10907 g/mol. IUPAC: 2-[[3-cyano-4-(trifluoromethyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-2-yl]sulfanyl]-N-(3,4-difluorophenyl)acetamide.
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