methyl 4-{[4-(4-methoxybenzene-1-sulfonyl)-7-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(4-methoxybenzene-1-sulfonyl)-7-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
methyl 4-{[4-(4-methoxybenzene-1-sulfonyl)-7-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | J014-2656 |
| Compound Name: | methyl 4-{[4-(4-methoxybenzene-1-sulfonyl)-7-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 496.54 |
| Molecular Formula: | C25 H24 N2 O7 S |
| Smiles: | Cc1ccc2c(c1)OC(CN2S(c1ccc(cc1)OC)(=O)=O)C(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1561 |
| logD: | 4.1554 |
| logSw: | -4.317 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.2 |
| InChI Key: | KUJNNWLEFGWDDK-HSZRJFAPSA-N |