ethyl 2-(2-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2109-0617 |
| Compound Name: | ethyl 2-(2-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 516.66 |
| Molecular Formula: | C24 H24 N2 O5 S3 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CN1C(/C(=C/c2ccc(cc2)OC)SC1=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8891 |
| logD: | 3.0139 |
| logSw: | -4.5669 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.604 |
| InChI Key: | HDCWHKBRADBAKX-UHFFFAOYSA-N |