tert-butyl 4-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1161 |
| Compound Name: | tert-butyl 4-{4-[4-(4-chlorophenyl)piperazine-1-carbonyl]-1-(4-nitrophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 595.1 |
| Molecular Formula: | C30 H35 Cl N6 O5 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)[N+]([O-])=O)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4489 |
| logD: | 6.4489 |
| logSw: | -6.203 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.433 |
| InChI Key: | GZMOWPHGOJRWSU-UHFFFAOYSA-N |