ethyl 2-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
ethyl 2-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J014-0272 |
| Compound Name: | ethyl 2-{[4-(methanesulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C20 H22 N2 O6 S |
| Smiles: | CCOC(c1ccccc1NC(C1CN(c2cc(C)ccc2O1)S(C)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0191 |
| logD: | 2.9156 |
| logSw: | -3.5757 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.302 |
| InChI Key: | USAPBGMMMAONRH-GOSISDBHSA-N |