N-(3-chloro-4-fluorophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-(3-chloro-4-fluorophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C849-0682 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 375.87 |
| Molecular Formula: | C18 H11 Cl F N O S2 |
| Smiles: | C1c2cc(C(Nc3ccc(c(c3)[Cl])F)=O)sc2c2ccccc2S1 |
| Stereo: | ACHIRAL |
| logP: | 5.638 |
| logD: | 5.631 |
| logSw: | -5.9788 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.997 |
| InChI Key: | WLBHUMPZSCCDDT-UHFFFAOYSA-N |