tert-butyl 4-{1-(3-fluorophenyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-fluorophenyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-fluorophenyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1686 |
| Compound Name: | tert-butyl 4-{1-(3-fluorophenyl)-4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 535.62 |
| Molecular Formula: | C28 H34 F N7 O3 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1cccc(c1)F)C(N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.042 |
| logD: | 5.042 |
| logSw: | -4.5768 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.414 |
| InChI Key: | QBTJEZIHQPKAJQ-UHFFFAOYSA-N |