methyl 2-{[4-(benzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(benzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
methyl 2-{[4-(benzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J014-1744 |
| Compound Name: | methyl 2-{[4-(benzenesulfonyl)-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 486.93 |
| Molecular Formula: | C23 H19 Cl N2 O6 S |
| Smiles: | COC(c1ccccc1NC(C1CN(c2cc(ccc2O1)[Cl])S(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0516 |
| logD: | 3.9481 |
| logSw: | -4.444 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.959 |
| InChI Key: | BXZNXKWWJUYTBZ-OAQYLSRUSA-N |