tert-butyl 4-(4-{[(4-chlorophenyl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-(4-{[(4-chlorophenyl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
tert-butyl 4-(4-{[(4-chlorophenyl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1301 |
| Compound Name: | tert-butyl 4-(4-{[(4-chlorophenyl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate |
| Molecular Weight: | 495.02 |
| Molecular Formula: | C27 H31 Cl N4 O3 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccccc1)C(NCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3861 |
| logD: | 6.386 |
| logSw: | -6.1153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.556 |
| InChI Key: | PYUAEGMNTKNNDB-UHFFFAOYSA-N |