2-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
Chemical Structure Depiction of
2-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
2-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid
Compound characteristics
| Compound ID: | 3215-1461 |
| Compound Name: | 2-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}ethane-1-sulfonic acid |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C14 H15 N O6 S3 |
| Smiles: | CCOc1cc(/C=C2/C(N(CCS(O)(=O)=O)C(=S)S2)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 0.1802 |
| logD: | -9.1376 |
| logSw: | -1.9673 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.51 |
| InChI Key: | SZNVQNHUWPEJKZ-UHFFFAOYSA-N |