2-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Chemical Structure Depiction of
2-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
2-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid
Compound characteristics
| Compound ID: | 2389-1027 |
| Compound Name: | 2-{5-[(3,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-3-phenylpropanoic acid |
| Molecular Weight: | 429.51 |
| Molecular Formula: | C21 H19 N O5 S2 |
| Smiles: | COc1ccc(/C=C2/C(N(C(Cc3ccccc3)C(O)=O)C(=S)S2)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2505 |
| logD: | 0.4269 |
| logSw: | -3.408 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.037 |
| InChI Key: | HQGKNONFPTVCHD-HNNXBMFYSA-N |