ethyl 2-anilino-4-oxo-5-{[4-(trifluoromethyl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-4-oxo-5-{[4-(trifluoromethyl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-4-oxo-5-{[4-(trifluoromethyl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y010-1909 |
| Compound Name: | ethyl 2-anilino-4-oxo-5-{[4-(trifluoromethyl)phenyl]methylidene}-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 419.42 |
| Molecular Formula: | C21 H16 F3 N O3 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2ccc(cc2)C(F)(F)F)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6635 |
| logD: | 5.6519 |
| logSw: | -5.6247 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.117 |
| InChI Key: | VOSKIXOMVVSEKZ-UHFFFAOYSA-N |