2-hydroxy-4-(3-{5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
Chemical Structure Depiction of
2-hydroxy-4-(3-{5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
2-hydroxy-4-(3-{5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
Compound characteristics
| Compound ID: | 5121-1642 |
| Compound Name: | 2-hydroxy-4-(3-{5-[(2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C21 H18 N2 O6 S2 |
| Smiles: | COc1ccccc1/C=C1/C(N(CCC(Nc2ccc(C(O)=O)c(c2)O)=O)C(=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0185 |
| logD: | 0.9896 |
| logSw: | -3.9284 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.157 |
| InChI Key: | AWQHCLIYASQDAH-UHFFFAOYSA-N |