2-{5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
Chemical Structure Depiction of
2-{5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
2-{5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
Compound characteristics
| Compound ID: | 3215-1462 |
| Compound Name: | 2-{5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid |
| Molecular Weight: | 375.44 |
| Molecular Formula: | C13 H13 N O6 S3 |
| Smiles: | COc1cc(/C=C2/C(N(CCS(O)(=O)=O)C(=S)S2)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | -0.3386 |
| logD: | -9.6564 |
| logSw: | -1.8252 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.93 |
| InChI Key: | SEDNIMBONGWZIC-XFFZJAGNSA-N |