2-hydroxy-4-(4-{4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl}butanamido)benzoic acid
Chemical Structure Depiction of
2-hydroxy-4-(4-{4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl}butanamido)benzoic acid
2-hydroxy-4-(4-{4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl}butanamido)benzoic acid
Compound characteristics
| Compound ID: | 4125-0310 |
| Compound Name: | 2-hydroxy-4-(4-{4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl}butanamido)benzoic acid |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C19 H16 N2 O5 S3 |
| Smiles: | C(CC(Nc1ccc(C(O)=O)c(c1)O)=O)CN1C(/C(=C\c2cccs2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2136 |
| logD: | 0.1847 |
| logSw: | -3.4052 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.545 |
| InChI Key: | NFNMSUBXDRPCNB-UHFFFAOYSA-N |