AC1MWG4M
2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-naphthalen-2-ylacetamide
Also Known As: Oprea1_529650|Oprea1_744223|J3.557.358E|AO-022/40937558|2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-naphthalen-2-ylacetamide|2-{[3-cyano-4-(2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2-naphthyl)acetamide|2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(naphthalen-2-yl)acetamide|2-((3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(naphthalen-2-yl)acetamide|2-[[3-Cyano-4-(2-furyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-2-yl]thio]-N-(2-naphthyl)acetamide|2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(naphthalen-2-yl)acetamide
| Molecular Formula | C26H21N3O3S |
|---|---|
| Molecular Weight | 455.13037 g/mol |
| LogP | 5.23378 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.13037 |
| Monoisotopic Mass | 455.13037 |
| Heavy Atoms | 33 |
| Complexity | 1348.6141 |
Chemical Identifiers
| CAS Number | 369398-06-1 |
|---|---|
| SMILES | C1CC2=C(C(C(=C(N2)SCC(=O)NC3=CC4=CC=CC=C4C=C3)C#N)C5=CC=CO5)C(=O)C1 |
Product Overview
AC1MWG4M (CAS 369398-06-1), with molecular formula C26H21N3O3S and molecular weight 455.13037 g/mol. IUPAC: 2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-naphthalen-2-ylacetamide.