1-(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)-2,2-dimethylpropan-1-one
Chemical Structure Depiction of
1-(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)-2,2-dimethylpropan-1-one
1-(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | V004-9491 |
| Compound Name: | 1-(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)-2,2-dimethylpropan-1-one |
| Molecular Weight: | 414.98 |
| Molecular Formula: | C23 H31 Cl N4 O |
| Smiles: | CCc1c(Cc2ccc(cc2)[Cl])c(nc(C)n1)N1CCN(CC1)C(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2769 |
| logD: | 5.1672 |
| logSw: | -5.7802 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.53 |
| InChI Key: | PHRFQDIQIBPKSC-UHFFFAOYSA-N |