6-(5-{[3-(benzyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoic acid
Chemical Structure Depiction of
6-(5-{[3-(benzyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoic acid
6-(5-{[3-(benzyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoic acid
Compound characteristics
| Compound ID: | 3453-1646 |
| Compound Name: | 6-(5-{[3-(benzyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoic acid |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C23 H23 N O4 S2 |
| Smiles: | C(CCC(O)=O)CCN1C(/C(=C/c2cccc(c2)OCc2ccccc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4117 |
| logD: | 1.5835 |
| logSw: | -4.4163 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.304 |
| InChI Key: | MDQAAYABMGVSER-UHFFFAOYSA-N |