N-(2-fluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-(2-fluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1237 |
| Compound Name: | N-(2-fluorophenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 301.34 |
| Molecular Formula: | C16 H12 F N O2 S |
| Smiles: | C1CSc2c(cccc2C(Nc2ccccc2F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0092 |
| logD: | 2.999 |
| logSw: | -3.7643 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.8 |
| InChI Key: | ROJQZKRFMZIPPP-UHFFFAOYSA-N |