ethyl 4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | Y500-1120 |
| Compound Name: | ethyl 4-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 453.46 |
| Molecular Formula: | C23 H26 F3 N O5 |
| Smiles: | CCOC(C1C(C2=C(CCCC2=O)NC=1C)c1ccc(c(COCC(F)(F)F)c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9732 |
| logD: | 0.0774 |
| logSw: | -4.1199 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.74 |
| InChI Key: | WMXRZNSWULNXON-FQEVSTJZSA-N |