ethyl 4-oxo-2-[({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)methyl]-1,4-dihydroquinoline-6-carboxylate
Chemical Structure Depiction of
ethyl 4-oxo-2-[({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)methyl]-1,4-dihydroquinoline-6-carboxylate
ethyl 4-oxo-2-[({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)methyl]-1,4-dihydroquinoline-6-carboxylate
Compound characteristics
| Compound ID: | G751-1672 |
| Compound Name: | ethyl 4-oxo-2-[({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)methyl]-1,4-dihydroquinoline-6-carboxylate |
| Molecular Weight: | 464.46 |
| Molecular Formula: | C22 H19 F3 N2 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)C(C=C(CSCC(Nc1cccc(c1)C(F)(F)F)=O)N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4548 |
| logD: | 5.2642 |
| logSw: | -5.5036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.665 |
| InChI Key: | DTLPVLAEPYEZCX-UHFFFAOYSA-N |