ethyl 4-oxo-2-[3-(trifluoromethyl)anilino]-5-[(2,3,4-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-oxo-2-[3-(trifluoromethyl)anilino]-5-[(2,3,4-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
ethyl 4-oxo-2-[3-(trifluoromethyl)anilino]-5-[(2,3,4-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V015-7146 |
| Compound Name: | ethyl 4-oxo-2-[3-(trifluoromethyl)anilino]-5-[(2,3,4-trimethoxyphenyl)methylidene]-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 509.5 |
| Molecular Formula: | C24 H22 F3 N O6 S |
| Smiles: | CCOC(C1=C(Nc2cccc(c2)C(F)(F)F)SC(=C\c2ccc(c(c2OC)OC)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9957 |
| logD: | 5.1 |
| logSw: | -5.6309 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.182 |
| InChI Key: | IPYDTEJFZSYACC-UHFFFAOYSA-N |