7,8-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
7,8-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
7,8-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | 6451-0737 |
| Compound Name: | 7,8-dimethoxy-1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 409.38 |
| Molecular Formula: | C19 H14 F3 N O4 S |
| Smiles: | COc1ccc2C=C(C(Nc3cccc(c3)C(F)(F)F)=O)SC(c2c1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5802 |
| logD: | 4.5777 |
| logSw: | -4.6646 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.67 |
| InChI Key: | MMXILUNRUVYBEY-UHFFFAOYSA-N |