methyl 3-{[4-(4-methoxybenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}-4-methylbenzoate
Chemical Structure Depiction of
methyl 3-{[4-(4-methoxybenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}-4-methylbenzoate
methyl 3-{[4-(4-methoxybenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}-4-methylbenzoate
Compound characteristics
| Compound ID: | J014-2418 |
| Compound Name: | methyl 3-{[4-(4-methoxybenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl]amino}-4-methylbenzoate |
| Molecular Weight: | 496.54 |
| Molecular Formula: | C25 H24 N2 O7 S |
| Smiles: | Cc1ccc(cc1NC(C1CN(c2ccccc2O1)S(c1ccc(cc1)OC)(=O)=O)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.965 |
| logD: | 3.9649 |
| logSw: | -4.1629 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.502 |
| InChI Key: | MWYQBZFQDNVMEC-HSZRJFAPSA-N |