ethyl 2-(3,4-dimethoxyanilino)-5-[(2,3-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,4-dimethoxyanilino)-5-[(2,3-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(3,4-dimethoxyanilino)-5-[(2,3-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V011-1686 |
| Compound Name: | ethyl 2-(3,4-dimethoxyanilino)-5-[(2,3-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C24 H25 N O7 S |
| Smiles: | CCOC(C1=C(Nc2ccc(c(c2)OC)OC)SC(=C\c2cccc(c2OC)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4456 |
| logD: | 4.2576 |
| logSw: | -4.3771 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.725 |
| InChI Key: | JXBBFGHUMXZGKL-UHFFFAOYSA-N |