3-(3-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
Chemical Structure Depiction of
3-(3-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
3-(3-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid
Compound characteristics
| Compound ID: | 4491-2131 |
| Compound Name: | 3-(3-{5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)benzoic acid |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C20 H15 Cl N2 O4 S2 |
| Smiles: | C(CN1C(/C(=C/c2ccc(cc2)[Cl])SC1=S)=O)C(Nc1cccc(c1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5701 |
| logD: | 1.6842 |
| logSw: | -4.7821 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.978 |
| InChI Key: | JZFIUVXJNCAABO-UHFFFAOYSA-N |