N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2-hydroxyethyl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2-hydroxyethyl)sulfanyl]acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2-hydroxyethyl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8013-7313 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2-hydroxyethyl)sulfanyl]acetamide |
| Molecular Weight: | 296.41 |
| Molecular Formula: | C13 H16 N2 O2 S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSCCO)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.9647 |
| logD: | 0.8874 |
| logSw: | -2.2515 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.814 |
| InChI Key: | CFWAEMZBYLLGRS-UHFFFAOYSA-N |