4-({2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Chemical Structure Depiction of
4-({2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
4-({2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 4514-0427 |
| Compound Name: | 4-({2-[(3,4-dimethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazinane-6-carbonyl}amino)benzoic acid |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | Cc1ccc(cc1C)/N=C1/N(C)C(CC(C(Nc2ccc(cc2)C(O)=O)=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0391 |
| logD: | 1.6439 |
| logSw: | -4.0094 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.584 |
| InChI Key: | TXLADILENRKEAD-KRWDZBQOSA-N |