tert-butyl 4-{1-(4-chlorophenyl)-4-[3-(4-methylphenyl)pyrrolidine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(4-chlorophenyl)-4-[3-(4-methylphenyl)pyrrolidine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(4-chlorophenyl)-4-[3-(4-methylphenyl)pyrrolidine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E951-0581 |
| Compound Name: | tert-butyl 4-{1-(4-chlorophenyl)-4-[3-(4-methylphenyl)pyrrolidine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 549.11 |
| Molecular Formula: | C31 H37 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1)C1CCN(C1)C(c1cnn(c2ccc(cc2)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5472 |
| logD: | 7.5472 |
| logSw: | -6.4298 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.819 |
| InChI Key: | XPMFQXYSHDRLFX-XMMPIXPASA-N |