ethyl 2-(4-ethoxyanilino)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-ethoxyanilino)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-ethoxyanilino)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4767-1312 |
| Compound Name: | ethyl 2-(4-ethoxyanilino)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 479.53 |
| Molecular Formula: | C26 H22 F N O5 S |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)OCC)SC(=C/c2ccc(c3ccc(cc3)F)o2)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6937 |
| logD: | 6.6684 |
| logSw: | -5.735 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.811 |
| InChI Key: | KVXYXMJHGFNYTO-UHFFFAOYSA-N |