2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoic acid
Chemical Structure Depiction of
2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoic acid
2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoic acid
Compound characteristics
| Compound ID: | 6275-3479 |
| Compound Name: | 2-{5-[(2,4-dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoic acid |
| Molecular Weight: | 413.53 |
| Molecular Formula: | C17 H19 N O5 S3 |
| Smiles: | COc1ccc(/C=C2/C(N(C(CCSC)C(O)=O)C(=S)S2)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7813 |
| logD: | -0.0695 |
| logSw: | -3.1424 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.222 |
| InChI Key: | UVUMEQJXUQOXTP-LBPRGKRZSA-N |