tert-butyl 4-{1-phenyl-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-phenyl-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-phenyl-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
Compound ID: | E955-1402 |
Compound Name: | tert-butyl 4-{1-phenyl-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
Molecular Weight: | 517.63 |
Molecular Formula: | C28 H35 N7 O3 |
Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccccc1)C(N1CCN(CC1)c1ncccn1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.85 |
logD: | 4.85 |
logSw: | -4.4626 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 73.414 |
InChI Key: | LEPBZRGKWDJXBE-UHFFFAOYSA-N |