3-methyl-1-{3-[(piperidin-1-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{3-[(piperidin-1-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl}butan-1-one
3-methyl-1-{3-[(piperidin-1-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V016-7018 |
| Compound Name: | 3-methyl-1-{3-[(piperidin-1-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 396.5 |
| Molecular Formula: | C22 H31 F3 N2 O |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CC(CN2CCCCC2)C(C1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7416 |
| logD: | 2.0526 |
| logSw: | -4.4602 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.3247 |
| InChI Key: | PPQJDTUPJSFOCN-UHFFFAOYSA-N |