3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid
Chemical Structure Depiction of
3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid
3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid
Compound characteristics
| Compound ID: | 5593-2180 |
| Compound Name: | 3-[(3,4-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)imino]-4-oxo-1,3-thiazinane-6-carboxylic acid |
| Molecular Weight: | 430.48 |
| Molecular Formula: | C21 H22 N2 O6 S |
| Smiles: | COc1ccc(cc1)/N=C1/N(Cc2ccc(c(c2)OC)OC)C(CC(C(O)=O)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4084 |
| logD: | -0.0256 |
| logSw: | -2.7498 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.26 |
| InChI Key: | BWEUGDHJEHSBDW-SFHVURJKSA-N |