2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Chemical Structure Depiction of
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Compound characteristics
| Compound ID: | 3331-2406 |
| Compound Name: | 2-{5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid |
| Molecular Weight: | 372.26 |
| Molecular Formula: | C13 H10 Br N O3 S2 |
| Smiles: | CC(C(O)=O)N1C(/C(=C\c2cccc(c2)[Br])SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7323 |
| logD: | -0.1493 |
| logSw: | -2.9838 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.463 |
| InChI Key: | RHSYBTCGCHMKMY-ZETCQYMHSA-N |