tert-butyl 4-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
tert-butyl 4-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1322 |
| Compound Name: | tert-butyl 4-(4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-phenyl-1H-pyrazol-5-yl)piperidine-1-carboxylate |
| Molecular Weight: | 504.59 |
| Molecular Formula: | C28 H32 N4 O5 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccccc1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7044 |
| logD: | 5.7044 |
| logSw: | -5.3048 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.672 |
| InChI Key: | HKIYSFJLRZXHPN-UHFFFAOYSA-N |