tert-butyl 4-{4-[(2-chloro-4-fluorophenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(2-chloro-4-fluorophenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(2-chloro-4-fluorophenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1368 |
| Compound Name: | tert-butyl 4-{4-[(2-chloro-4-fluorophenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 498.98 |
| Molecular Formula: | C26 H28 Cl F N4 O3 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccccc1)C(Nc1ccc(cc1[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.459 |
| logD: | 6.3104 |
| logSw: | -6.0875 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.536 |
| InChI Key: | YQKYUYRBDFCQBC-UHFFFAOYSA-N |