2,5-dioxo-N-(2-oxothiolan-3-yl)-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
2,5-dioxo-N-(2-oxothiolan-3-yl)-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
2,5-dioxo-N-(2-oxothiolan-3-yl)-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8015-8971 |
| Compound Name: | 2,5-dioxo-N-(2-oxothiolan-3-yl)-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C20 H18 N2 O4 S |
| Smiles: | C1CC2=C(C=C(C(NC3CCSC3=O)=O)C(N2c2ccccc2)=O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1941 |
| logD: | 0.974 |
| logSw: | -2.2119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.547 |
| InChI Key: | GTJCWZXNGJKVLA-OAHLLOKOSA-N |