tert-butyl 4-{4-[(5-chloro-2-methylphenyl)carbamoyl]-1-(2-chlorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(5-chloro-2-methylphenyl)carbamoyl]-1-(2-chlorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(5-chloro-2-methylphenyl)carbamoyl]-1-(2-chlorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-5093 |
| Compound Name: | tert-butyl 4-{4-[(5-chloro-2-methylphenyl)carbamoyl]-1-(2-chlorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 529.47 |
| Molecular Formula: | C27 H30 Cl2 N4 O3 |
| Smiles: | Cc1ccc(cc1NC(c1cnn(c2ccccc2[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.021 |
| logD: | 7.0162 |
| logSw: | -6.201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.236 |
| InChI Key: | JKRBUVQICSRVPL-UHFFFAOYSA-N |