2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Chemical Structure Depiction of
2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | D360-0491 |
| Compound Name: | 2-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide |
| Molecular Weight: | 464.99 |
| Molecular Formula: | C23 H17 Cl N4 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSc1c(C#N)ccc(c3ccc(cc3)[Cl])n1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.9335 |
| logD: | 4.8283 |
| logSw: | -6.2314 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.419 |
| InChI Key: | RXRLZGNETCQZSU-UHFFFAOYSA-N |