1-[4-(2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidin-4-yl)piperazin-1-yl]-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-[4-(2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidin-4-yl)piperazin-1-yl]-3,5,5-trimethylhexan-1-one
1-[4-(2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidin-4-yl)piperazin-1-yl]-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V008-8420 |
| Compound Name: | 1-[4-(2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidin-4-yl)piperazin-1-yl]-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C27 H37 F3 N4 O |
| Salt: | not_available |
| Smiles: | CC(CC(N1CCN(CC1)c1c(Cc2cccc(c2)C(F)(F)F)c(C)nc(C)n1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2906 |
| logD: | 6.2016 |
| logSw: | -5.6957 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.314 |
| InChI Key: | YQSGMZKUOBJHCO-GOSISDBHSA-N |