ethyl 5-[(2,4-dichlorophenyl)methylidene]-2-(4-methylbenzamido)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(2,4-dichlorophenyl)methylidene]-2-(4-methylbenzamido)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(2,4-dichlorophenyl)methylidene]-2-(4-methylbenzamido)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-3124 |
| Compound Name: | ethyl 5-[(2,4-dichlorophenyl)methylidene]-2-(4-methylbenzamido)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 462.35 |
| Molecular Formula: | C22 H17 Cl2 N O4 S |
| Smiles: | CCOC(C1=C(NC(c2ccc(C)cc2)=O)SC(=C/c2ccc(cc2[Cl])[Cl])\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1288 |
| logD: | 3.173 |
| logSw: | -6.1936 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.296 |
| InChI Key: | ZCKCWQVIKYTQOR-UHFFFAOYSA-N |