tert-butyl 4-{1-(4-nitrophenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(4-nitrophenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(4-nitrophenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1243 |
| Compound Name: | tert-butyl 4-{1-(4-nitrophenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 605.65 |
| Molecular Formula: | C30 H35 N7 O7 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)[N+]([O-])=O)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7798 |
| logD: | 5.7798 |
| logSw: | -5.3823 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 121.815 |
| InChI Key: | MKKIDKFLRIJABF-UHFFFAOYSA-N |