N-tert-butyl-4-{5-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-{5-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}piperazine-1-carboxamide
N-tert-butyl-4-{5-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V004-1282 |
| Compound Name: | N-tert-butyl-4-{5-[(2-chloro-6-fluorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}piperazine-1-carboxamide |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C24 H33 Cl F N5 O |
| Salt: | not_available |
| Smiles: | CC(C)c1c(Cc2c(cccc2[Cl])F)c(nc(C)n1)N1CCN(CC1)C(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1444 |
| logD: | 6.0991 |
| logSw: | -6.1635 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.001 |
| InChI Key: | NUBLFKRUDBXABX-UHFFFAOYSA-N |