N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chloro-2-methylphenyl)-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-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-2174 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chloro-2-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 489.4 |
| Molecular Formula: | C24 H25 Cl N4 O3 |
| Salt: | HCl |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCNCC2)c(cn1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4856 |
| logD: | 0.0046 |
| logSw: | -3.8547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.442 |
| InChI Key: | LAYQKMIVXFJNOH-UHFFFAOYSA-N |