N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-0612 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 475.37 |
| Molecular Formula: | C23 H23 Cl N4 O3 |
| Salt: | HCl |
| Smiles: | C1CNCCC1c1c(cnn1c1ccc(cc1)[Cl])C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0481 |
| logD: | -0.4329 |
| logSw: | -3.6303 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.743 |
| InChI Key: | BEUZWCKKRQVSBO-UHFFFAOYSA-N |