ethyl 2-(2-fluoroanilino)-5-[(2-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-fluoroanilino)-5-[(2-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(2-fluoroanilino)-5-[(2-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V022-8528 |
| Compound Name: | ethyl 2-(2-fluoroanilino)-5-[(2-hydroxy-3-methylphenyl)methylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C21 H18 F N O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccccc2F)SC(=C\c2cccc(C)c2O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4042 |
| logD: | 4.917 |
| logSw: | -5.2256 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.898 |
| InChI Key: | UVBRASDFOINHTG-UHFFFAOYSA-N |