2-[4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanamido]benzoic acid
Chemical Structure Depiction of
2-[4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanamido]benzoic acid
2-[4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanamido]benzoic acid
Compound characteristics
| Compound ID: | 2110-0055 |
| Compound Name: | 2-[4-(5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanamido]benzoic acid |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C21 H18 N2 O4 S2 |
| Smiles: | C(CC(Nc1ccccc1C(O)=O)=O)CN1C(/C(=C/c2ccccc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5892 |
| logD: | -0.8238 |
| logSw: | -3.7603 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.28 |
| InChI Key: | ZLDLRMXBPMWDMZ-UHFFFAOYSA-N |