5-(3-{5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-2-hydroxybenzoic acid
Chemical Structure Depiction of
5-(3-{5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-2-hydroxybenzoic acid
5-(3-{5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-2-hydroxybenzoic acid
Compound characteristics
| Compound ID: | 4125-0345 |
| Compound Name: | 5-(3-{5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-2-hydroxybenzoic acid |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C22 H20 N2 O5 S2 |
| Smiles: | CCc1ccc(/C=C2/C(N(CCC(Nc3ccc(c(c3)C(O)=O)O)=O)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1181 |
| logD: | 1.5976 |
| logSw: | -4.6157 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.526 |
| InChI Key: | HRDXQLYCMBCNCX-UHFFFAOYSA-N |