2-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}butanoic acid
Chemical Structure Depiction of
2-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}butanoic acid
2-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}butanoic acid
Compound characteristics
| Compound ID: | 6275-3476 |
| Compound Name: | 2-{4-oxo-5-[(pyridin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}butanoic acid |
| Molecular Weight: | 308.38 |
| Molecular Formula: | C13 H12 N2 O3 S2 |
| Smiles: | CCC(C(O)=O)N1C(/C(=C/c2cccnc2)SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3626 |
| logD: | -1.4882 |
| logSw: | -1.3859 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.565 |
| InChI Key: | DLJAWAOAHJQVKI-VIFPVBQESA-N |