tert-butyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-5477 |
| Compound Name: | tert-butyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 519.6 |
| Molecular Formula: | C28 H33 N5 O5 |
| Smiles: | Cc1ccc(cc1C)NC(c1cnn(c2ccc(cc2)[N+]([O-])=O)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8623 |
| logD: | 6.8623 |
| logSw: | -5.4705 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.616 |
| InChI Key: | GBFHVPROZIYNQZ-UHFFFAOYSA-N |