ethyl 5-({4-[(4-fluorophenyl)methoxy]phenyl}methylidene)-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({4-[(4-fluorophenyl)methoxy]phenyl}methylidene)-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-({4-[(4-fluorophenyl)methoxy]phenyl}methylidene)-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4767-1293 |
| Compound Name: | ethyl 5-({4-[(4-fluorophenyl)methoxy]phenyl}methylidene)-2-(4-methylanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C28 H24 F N O4 S |
| Smiles: | CCOC(C1=C(Nc2ccc(C)cc2)SC(=C/c2ccc(cc2)OCc2ccc(cc2)F)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8492 |
| logD: | 6.834 |
| logSw: | -5.7511 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.345 |
| InChI Key: | FTAZQLXJJOKQTR-UHFFFAOYSA-N |