AC1MMKIF
2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-fluorophenyl)acetamide
Also Known As: 2-((4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(2-fluorophenyl)acetamide|2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-fluorophenyl)acetamide|2-{[4-(4-chlorophenyl)-3-cyano-5-hydroxy-7,7-dimethyl-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide|2-{[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
| Molecular Formula | C26H23ClFN3O2S |
|---|---|
| Molecular Weight | 495.11835 g/mol |
| LogP | 5.91618 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.11835 |
| Monoisotopic Mass | 495.11835 |
| Heavy Atoms | 34 |
| Complexity | 1261.552 |
Chemical Identifiers
| CAS Number | 799800-67-2 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(N2)SCC(=O)NC3=CC=CC=C3F)C#N)C4=CC=C(C=C4)Cl)C(=O)C1)C |
Product Overview
AC1MMKIF (CAS 799800-67-2), with molecular formula C26H23ClFN3O2S and molecular weight 495.11835 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-fluorophenyl)acetamide.
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