6-methyl-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
6-methyl-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
6-methyl-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | E245-0397 |
| Compound Name: | 6-methyl-N-[3-(methylsulfanyl)phenyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 364.44 |
| Molecular Formula: | C16 H16 N2 O4 S2 |
| Smiles: | Cc1cc2c(cc1S(Nc1cccc(c1)SC)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.428 |
| logD: | 2.4225 |
| logSw: | -2.8821 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.158 |
| InChI Key: | GECMUUHJDIFRCI-UHFFFAOYSA-N |