3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]propanamide
Compound characteristics
| Compound ID: | E511-0668 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]propanamide |
| Molecular Weight: | 478.83 |
| Molecular Formula: | C18 H14 Cl F3 N2 O6 S |
| Smiles: | C(CS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)C(Nc1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0199 |
| logD: | 2.9984 |
| logSw: | -3.5647 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.359 |
| InChI Key: | BHFNIMPABYVWNO-UHFFFAOYSA-N |