7-chloro-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0489 |
| Compound Name: | 7-chloro-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 432.02 |
| Molecular Formula: | C21 H18 Cl N O S3 |
| Smiles: | CSc1ccc(CCNC(c2cc3CSc4cc(ccc4c3s2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8235 |
| logD: | 5.8235 |
| logSw: | -5.8919 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.1606 |
| InChI Key: | YMEVNNLWXAKVIR-UHFFFAOYSA-N |