methyl 4-[({4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}methyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[({4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}methyl)amino]benzoate
methyl 4-[({4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}methyl)amino]benzoate
Compound characteristics
| Compound ID: | 8004-5517 |
| Compound Name: | methyl 4-[({4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}methyl)amino]benzoate |
| Molecular Weight: | 474.55 |
| Molecular Formula: | C22 H22 N2 O6 S2 |
| Smiles: | COC(c1ccc(cc1)NCN1C(/C(=C\c2cc(c(c(c2)OC)OC)OC)SC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1087 |
| logD: | 4.1087 |
| logSw: | -4.324 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.754 |
| InChI Key: | WKPVSIQXJJEEKU-UHFFFAOYSA-N |