(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)(cyclobutyl)methanone
Chemical Structure Depiction of
(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)(cyclobutyl)methanone
(4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)(cyclobutyl)methanone
Compound characteristics
| Compound ID: | V030-7208 |
| Compound Name: | (4-{2-(butan-2-yl)-5-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)(cyclobutyl)methanone |
| Molecular Weight: | 459.01 |
| Molecular Formula: | C25 H32 Cl F N4 O |
| Smiles: | CCC(C)c1nc(C)c(Cc2c(cccc2[Cl])F)c(n1)N1CCN(CC1)C(C1CCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6027 |
| logD: | 5.5449 |
| logSw: | -5.8006 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.48 |
| InChI Key: | PIJRQNNBIXDHNL-INIZCTEOSA-N |