2-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Chemical Structure Depiction of
2-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
2-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid
Compound characteristics
| Compound ID: | 4491-1135 |
| Compound Name: | 2-{5-[(4-butoxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanoic acid |
| Molecular Weight: | 395.49 |
| Molecular Formula: | C18 H21 N O5 S2 |
| Smiles: | CCCCOc1ccc(/C=C2/C(N(C(C)C(O)=O)C(=S)S2)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0437 |
| logD: | 0.1621 |
| logSw: | -3.1182 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.598 |
| InChI Key: | ZAMOHVQOKWBVCH-NSHDSACASA-N |