ethyl 2-(3-{5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-{5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3-{5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2534-6517 |
| Compound Name: | ethyl 2-(3-{5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}propanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 514.68 |
| Molecular Formula: | C25 H26 N2 O4 S3 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CCN1C(/C(=C/c2ccc(C)cc2)SC1=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3666 |
| logD: | 2.7034 |
| logSw: | -5.3645 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.039 |
| InChI Key: | OGSILGIVHZWIGB-UHFFFAOYSA-N |