4-({3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Chemical Structure Depiction of
4-({3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
4-({3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 5593-2131 |
| Compound Name: | 4-({3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid |
| Molecular Weight: | 549.6 |
| Molecular Formula: | C28 H27 N3 O7 S |
| Smiles: | COc1ccc(cc1)/N=C1/N(Cc2ccc(c(c2)OC)OC)C(CC(C(Nc2ccc(cc2)C(O)=O)=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1219 |
| logD: | 1.7267 |
| logSw: | -4.2527 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.351 |
| InChI Key: | QRWYISYITLLPOD-DEOSSOPVSA-N |