tert-butyl 4-{1-(4-nitrophenyl)-4-[(2-phenylethyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(4-nitrophenyl)-4-[(2-phenylethyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(4-nitrophenyl)-4-[(2-phenylethyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1233 |
| Compound Name: | tert-butyl 4-{1-(4-nitrophenyl)-4-[(2-phenylethyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 519.6 |
| Molecular Formula: | C28 H33 N5 O5 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)[N+]([O-])=O)C(NCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7721 |
| logD: | 5.7721 |
| logSw: | -5.3795 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.779 |
| InChI Key: | VKXLNQMQRGTBIL-UHFFFAOYSA-N |