N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(phenylsulfanyl)acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(phenylsulfanyl)acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(phenylsulfanyl)acetamide
Compound characteristics
| Compound ID: | 8755-0187 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(phenylsulfanyl)acetamide |
| Molecular Weight: | 328.45 |
| Molecular Formula: | C17 H16 N2 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSc1ccccc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.9515 |
| logD: | 2.7728 |
| logSw: | -4.3449 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.887 |
| InChI Key: | QLVVZECZULJDCA-UHFFFAOYSA-N |