N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
Compound characteristics
| Compound ID: | D282-0424 |
| Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide |
| Molecular Weight: | 393.53 |
| Molecular Formula: | C21 H19 N3 O S2 |
| Smiles: | CC1CCc2c(C#N)c(NC(Cc3csc(c4ccccc4)n3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1822 |
| logD: | 3.9681 |
| logSw: | -5.1405 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.117 |
| InChI Key: | TYBYNSSRXXAIOD-CYBMUJFWSA-N |