2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | 4296-0441 |
| Compound Name: | 2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C24 H23 N3 O2 S2 |
| Smiles: | Cc1cccc(C)c1NC(CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8608 |
| logD: | 0.9703 |
| logSw: | -3.9661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.17 |
| InChI Key: | RXXNEIJUPUUAOQ-NRFANRHFSA-N |