1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
Chemical Structure Depiction of
1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one
Compound characteristics
| Compound ID: | V027-4028 |
| Compound Name: | 1-(4-{5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)-3-methylbutan-1-one |
| Molecular Weight: | 461.02 |
| Molecular Formula: | C25 H34 Cl F N4 O |
| Smiles: | CCc1c(Cc2c(cccc2[Cl])F)c(nc(C(C)C)n1)N1CCN(CC1)C(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2467 |
| logD: | 6.1902 |
| logSw: | -6.2361 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.39 |
| InChI Key: | HAIOXNMVQAXQNB-UHFFFAOYSA-N |