ethyl 2-(4-ethoxyanilino)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-ethoxyanilino)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-ethoxyanilino)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-6032 |
| Compound Name: | ethyl 2-(4-ethoxyanilino)-5-[(2-hydroxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C23 H23 N O6 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)OCC)SC(=C\c2ccc(cc2O)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2597 |
| logD: | 5.2357 |
| logSw: | -4.8505 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.333 |
| InChI Key: | ZZLCCOLZCYPAAA-UHFFFAOYSA-N |