methyl 4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 3192-2842 |
| Compound Name: | methyl 4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 523.46 |
| Molecular Formula: | C26 H22 F5 N O5 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(c(COc2c(c(c(c(c2F)F)F)F)F)c1)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9787 |
| logD: | 1.083 |
| logSw: | -4.8238 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.126 |
| InChI Key: | NUNDVTAZZJZDSZ-SFHVURJKSA-N |