1-{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-3,5,5-trimethylhexan-1-one
1-{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V005-9742 |
| Compound Name: | 1-{4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl}-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 498.71 |
| Molecular Formula: | C32 H42 N4 O |
| Salt: | not_available |
| Smiles: | CC(CC(N1CCN(CC1)c1c(Cc2ccccc2)c(C)nc(c2cccc(C)c2)n1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.09 |
| logD: | 7.9258 |
| logSw: | -5.7265 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.429 |
| InChI Key: | GFVNCGVTLFKUBY-XMMPIXPASA-N |