tert-butyl 4-[1-(2-chlorophenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(2-chlorophenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(2-chlorophenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1442 |
| Compound Name: | tert-butyl 4-[1-(2-chlorophenyl)-4-{[(2-chlorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 529.47 |
| Molecular Formula: | C27 H30 Cl2 N4 O3 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccccc1[Cl])C(NCc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1114 |
| logD: | 7.1113 |
| logSw: | -6.1906 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.256 |
| InChI Key: | AFFQLPRZXFYFML-UHFFFAOYSA-N |