N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyridin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyridin-2-yl)sulfanyl]acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyridin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8007-8759 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyridin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 329.44 |
| Molecular Formula: | C16 H15 N3 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSc1ccccn1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.0766 |
| logD: | 1.9714 |
| logSw: | -3.3828 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.296 |
| InChI Key: | IXOZJVPCVJWUBX-UHFFFAOYSA-N |