tert-butyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-5346 |
| Compound Name: | tert-butyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 581.55 |
| Molecular Formula: | C30 H37 Br N4 O3 |
| Smiles: | CC(C)c1ccc(cc1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1ccc(c(C)c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 8.462 |
| logD: | 8.4604 |
| logSw: | -5.5263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.234 |
| InChI Key: | IJQPTMPPSGLGEI-UHFFFAOYSA-N |