ethyl 2-anilino-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3947-1835 |
| Compound Name: | ethyl 2-anilino-5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C22 H21 N O6 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2cc(c(c(c2)OC)O)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8432 |
| logD: | 3.8316 |
| logSw: | -3.8827 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.857 |
| InChI Key: | DMLWSTWMFPVYSI-UHFFFAOYSA-N |