N-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1234 |
| Compound Name: | N-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 319.33 |
| Molecular Formula: | C16 H11 F2 N O2 S |
| Smiles: | C1CSc2c(cccc2C(Nc2ccc(cc2F)F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.1449 |
| logD: | 2.7487 |
| logSw: | -3.6916 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.8 |
| InChI Key: | FVYVSOZDMBLOHI-UHFFFAOYSA-N |