methyl 4-chloro-3-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-chloro-3-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
methyl 4-chloro-3-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J014-0404 |
| Compound Name: | methyl 4-chloro-3-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C19 H19 Cl N2 O6 S |
| Smiles: | Cc1ccc2c(c1)N(CC(C(Nc1cc(ccc1[Cl])C(=O)OC)=O)O2)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2039 |
| logD: | 3.1997 |
| logSw: | -3.576 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.723 |
| InChI Key: | LBJIOGYKBVGTKW-KRWDZBQOSA-N |