N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | C760-0505 |
| Compound Name: | N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 331.5 |
| Molecular Formula: | C18 H21 N O S2 |
| Smiles: | CSc1ccc(CCNC(c2csc3CCCCc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6459 |
| logD: | 4.6459 |
| logSw: | -4.3881 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.4322 |
| InChI Key: | CGDMCOPGWOZICQ-UHFFFAOYSA-N |