ethyl 5-[(4-methoxyphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(4-methoxyphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(4-methoxyphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3096-0350 |
| Compound Name: | ethyl 5-[(4-methoxyphenyl)methylidene]-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C22 H21 N O4 S |
| Smiles: | CCOC(C1=C(Nc2ccc(C)cc2)SC(=C/c2ccc(cc2)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3882 |
| logD: | 5.373 |
| logSw: | -5.4264 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.661 |
| InChI Key: | HDZZKAMUKMRART-UHFFFAOYSA-N |