N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[oxo(phenyl)acetyl]benzamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[oxo(phenyl)acetyl]benzamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[oxo(phenyl)acetyl]benzamide
Compound characteristics
| Compound ID: | 3992-0668 |
| Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[oxo(phenyl)acetyl]benzamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C25 H20 N2 O3 S |
| Smiles: | CC1CCc2c(C#N)c(NC(c3ccc(cc3)C(C(c3ccccc3)=O)=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1629 |
| logD: | 2.4243 |
| logSw: | -5.1701 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.307 |
| InChI Key: | BIZJNXZVDYTJMX-OAHLLOKOSA-N |