tert-butyl 4-{1-(4-chlorophenyl)-4-[(2,4-dimethylphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(4-chlorophenyl)-4-[(2,4-dimethylphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(4-chlorophenyl)-4-[(2,4-dimethylphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-5104 |
| Compound Name: | tert-butyl 4-{1-(4-chlorophenyl)-4-[(2,4-dimethylphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 509.05 |
| Molecular Formula: | C28 H33 Cl N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1cnn(c2ccc(cc2)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2248 |
| logD: | 7.2247 |
| logSw: | -6.293 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.536 |
| InChI Key: | XTHHBYHKXSPJGB-UHFFFAOYSA-N |