3-{4-oxo-5-[(pyridin-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Chemical Structure Depiction of
3-{4-oxo-5-[(pyridin-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
3-{4-oxo-5-[(pyridin-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Compound characteristics
| Compound ID: | 4790-0071 |
| Compound Name: | 3-{4-oxo-5-[(pyridin-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid |
| Molecular Weight: | 294.35 |
| Molecular Formula: | C12 H10 N2 O3 S2 |
| Smiles: | C(CN1C(/C(=C\c2ccncc2)SC1=S)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5019 |
| logD: | -2.0307 |
| logSw: | -1.3973 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.504 |
| InChI Key: | UBLZDBJNBXCPKR-UHFFFAOYSA-N |