ethyl 2-anilino-5-[(3-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-[(3-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-[(3-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3770-0019 |
| Compound Name: | ethyl 2-anilino-5-[(3-methoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C21 H19 N O4 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2cccc(c2)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7469 |
| logD: | 4.7354 |
| logSw: | -4.5252 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.661 |
| InChI Key: | HBRDLVIWHXCECZ-UHFFFAOYSA-N |