6-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
Chemical Structure Depiction of
6-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
6-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid
Compound characteristics
Compound ID: | 6236-4635 |
Compound Name: | 6-{5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}hexanoic acid |
Molecular Weight: | 395.49 |
Molecular Formula: | C18 H21 N O5 S2 |
Smiles: | CCOc1cc(/C=C2/C(N(CCCCCC(O)=O)C(=S)S2)=O)ccc1O |
Stereo: | ACHIRAL |
logP: | 2.7232 |
logD: | -0.105 |
logSw: | -2.789 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.835 |
InChI Key: | ZIOOTNADEVWEKM-UHFFFAOYSA-N |