tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(4-methoxyphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(4-methoxyphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(4-methoxyphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1071 |
| Compound Name: | tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(4-methoxyphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 529.01 |
| Molecular Formula: | C27 H30 Cl F N4 O4 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)OC)C(Nc1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6617 |
| logD: | 6.5148 |
| logSw: | -6.357 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.778 |
| InChI Key: | CKCUICYWVPQNNE-UHFFFAOYSA-N |