ChemDiv1_028653
N-(3-chlorophenyl)-2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide
Also Known As: ChemDiv1_028653|ChemDivAM_000339|Oprea1_072774|Oprea1_098252|HMS668G09|NCGC00282417-01|AB00673468-01|AB00673468-02|N-(3-chlorophenyl)-2-{[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide|AO-022/40937602|SR-01000484607-1|F1155-0201|N-(3-chlorophenyl)-2-{[3-cyano-5-hydroxy-4-(5-methylfuran-2-yl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide|N-(3-chlorophenyl)-2-((3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)acetamide|N-(3-chlorophenyl)-2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide|N-(3-chlorophenyl)-2-{[3-cyano-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}acetamide
| Molecular Formula | C23H20ClN3O3S |
|---|---|
| Molecular Weight | 453.0914 g/mol |
| LogP | 5.0424 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.0914 |
| Monoisotopic Mass | 453.0914 |
| Heavy Atoms | 31 |
| Complexity | 1158.8116 |
Chemical Identifiers
| CAS Number | 369394-96-7 |
|---|---|
| SMILES | CC1=CC=C(O1)C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=CC(=CC=C4)Cl)C#N |
Product Overview
ChemDiv1_028653 (CAS 369394-96-7), with molecular formula C23H20ClN3O3S and molecular weight 453.0914 g/mol. IUPAC: N-(3-chlorophenyl)-2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide.