6-{5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
Chemical Structure Depiction of
6-{5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
6-{5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
Compound characteristics
| Compound ID: | 3453-1633 |
| Compound Name: | 6-{5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid |
| Molecular Weight: | 379.5 |
| Molecular Formula: | C18 H21 N O4 S2 |
| Smiles: | CCOc1ccccc1\C=C1/C(N(CCCCCC(O)=O)C(=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6662 |
| logD: | 0.8381 |
| logSw: | -3.8156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.286 |
| InChI Key: | PQYWGMWQZITRDB-UHFFFAOYSA-N |