1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3,5,5-trimethylhexan-1-one
1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V004-9438 |
| Compound Name: | 1-(4-{5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 457.06 |
| Molecular Formula: | C26 H37 Cl N4 O |
| Salt: | not_available |
| Smiles: | CC(CC(N1CCN(CC1)c1c(Cc2ccc(cc2)[Cl])c(C)nc(C)n1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.083 |
| logD: | 5.994 |
| logSw: | -6.1621 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.314 |
| InChI Key: | LBYHDGGXKRNXHT-GOSISDBHSA-N |