N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-nitrophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-nitrophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-nitrophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-1228 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-nitrophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 506.39 |
| Molecular Formula: | C23 H24 Cl N5 O4 |
| Salt: | HCl |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(c1cnn(c2ccc(cc2)[N+]([O-])=O)c1C1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6514 |
| logD: | 0.1704 |
| logSw: | -4.0325 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.619 |
| InChI Key: | BCQDHTHRCQAEQZ-UHFFFAOYSA-N |