2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-methylbutanoic acid
Chemical Structure Depiction of
2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-methylbutanoic acid
2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-methylbutanoic acid
Compound characteristics
| Compound ID: | 2595-0100 |
| Compound Name: | 2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-methylbutanoic acid |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C17 H19 N O5 S2 |
| Smiles: | CC(C)C(C(O)=O)N1C(/C(=C/c2ccc(cc2OC)OC)SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1121 |
| logD: | 0.292 |
| logSw: | -3.3009 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.257 |
| InChI Key: | PCHKVMPCCBNGES-AWEZNQCLSA-N |