4-(benzenesulfonyl)-N-[3-(methylsulfanyl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
4-(benzenesulfonyl)-N-[3-(methylsulfanyl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
4-(benzenesulfonyl)-N-[3-(methylsulfanyl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-1193 |
| Compound Name: | 4-(benzenesulfonyl)-N-[3-(methylsulfanyl)phenyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C22 H20 N2 O4 S2 |
| Smiles: | CSc1cccc(c1)NC(C1CN(c2ccccc2O1)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9073 |
| logD: | 3.9072 |
| logSw: | -3.9673 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.482 |
| InChI Key: | FPABLOGGBWDPTD-OAQYLSRUSA-N |