ethyl 2-anilino-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-3078 |
| Compound Name: | ethyl 2-anilino-5-[(3-ethoxy-4-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C23 H23 N O5 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2ccc(c(c2)OCC)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5349 |
| logD: | 4.5234 |
| logSw: | -4.3176 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.958 |
| InChI Key: | DMIVPIGQHMSLGX-UHFFFAOYSA-N |