tert-butyl 4-{4-[(2,6-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(2,6-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(2,6-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1168 |
| Compound Name: | tert-butyl 4-{4-[(2,6-dimethylphenyl)carbamoyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 519.6 |
| Molecular Formula: | C28 H33 N5 O5 |
| Smiles: | Cc1cccc(C)c1NC(c1cnn(c2ccc(cc2)[N+]([O-])=O)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9222 |
| logD: | 5.9221 |
| logSw: | -5.3905 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.22 |
| InChI Key: | AAKZDUGZANPQLG-UHFFFAOYSA-N |