tert-butyl 4-{4-[(2-bromophenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(2-bromophenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(2-bromophenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C429-0649 |
| Compound Name: | tert-butyl 4-{4-[(2-bromophenyl)carbamoyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 539.47 |
| Molecular Formula: | C27 H31 Br N4 O3 |
| Smiles: | Cc1ccc(cc1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.8336 |
| logD: | 6.8332 |
| logSw: | -5.5902 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.536 |
| InChI Key: | CFUMWMLQVVVOPS-UHFFFAOYSA-N |