1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
Chemical Structure Depiction of
1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
Compound characteristics
| Compound ID: | V001-4821 |
| Compound Name: | 1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one |
| Molecular Weight: | 418.94 |
| Molecular Formula: | C22 H28 Cl F N4 O |
| Smiles: | CC(C)CC(N1CCN(CC1)c1c(Cc2c(cccc2[Cl])F)c(C)nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.703 |
| logD: | 4.6741 |
| logSw: | -4.7773 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.314 |
| InChI Key: | UTGWJOPONDKZBN-UHFFFAOYSA-N |