N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide
Compound characteristics
| Compound ID: | 1000-0388 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-methylbenzamide |
| Molecular Weight: | 296.39 |
| Molecular Formula: | C17 H16 N2 O S |
| Smiles: | Cc1ccc(cc1)C(Nc1c(C#N)c2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1006 |
| logD: | 1.3947 |
| logSw: | -4.2934 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.101 |
| InChI Key: | FOOIMSQPUWKROS-UHFFFAOYSA-N |