N-(5-chloro-2,4-dimethoxyphenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-(5-chloro-2,4-dimethoxyphenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-2012 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 519.47 |
| Molecular Formula: | C26 H31 Cl N4 O3 |
| Salt: | HCl |
| Smiles: | CC(C)c1ccc(cc1)n1c(C2CCNCC2)c(cn1)C(Nc1cc(c(cc1OC)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4118 |
| logD: | 0.9308 |
| logSw: | -4.6151 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.868 |
| InChI Key: | IETCDFUMLDQMEX-UHFFFAOYSA-N |