ethyl 5-[(2,4-dimethoxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(2,4-dimethoxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-[(2,4-dimethoxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
Compound ID: | 4302-2354 |
Compound Name: | ethyl 5-[(2,4-dimethoxyphenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
Molecular Weight: | 441.5 |
Molecular Formula: | C23 H23 N O6 S |
Smiles: | CCOC(C1=C(Nc2ccc(cc2)OC)SC(=C/c2ccc(cc2OC)OC)\C1=O)=O |
Stereo: | ACHIRAL |
logP: | 5.152 |
logD: | 5.128 |
logSw: | -5.0526 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.835 |
InChI Key: | JERZSGCIYRDWGK-UHFFFAOYSA-N |