tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
Compound ID: | E951-0107 |
Compound Name: | tert-butyl 4-[4-(4-benzylpiperazine-1-carbonyl)-1-(4-fluorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate |
Molecular Weight: | 547.67 |
Molecular Formula: | C31 H38 F N5 O3 |
Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)F)C(N1CCN(CC1)Cc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.517 |
logD: | 5.5016 |
logSw: | -5.3042 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 55.332 |
InChI Key: | KEUAWONRHOVYNW-UHFFFAOYSA-N |