tert-butyl 4-{4-[(2,5-dimethylphenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(2,5-dimethylphenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(2,5-dimethylphenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C429-0567 |
| Compound Name: | tert-butyl 4-{4-[(2,5-dimethylphenyl)carbamoyl]-1-phenyl-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C28 H34 N4 O3 |
| Smiles: | Cc1ccc(C)c(c1)NC(c1cnn(c2ccccc2)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0671 |
| logD: | 6.067 |
| logSw: | -5.2752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.536 |
| InChI Key: | XTYLEQZKGGLSIM-UHFFFAOYSA-N |