N-(2-methoxy-5-nitrophenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-(2-methoxy-5-nitrophenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C614-5665 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-5-(piperidin-4-yl)-1-[4-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 500 |
| Molecular Formula: | C25 H29 N5 O4 |
| Salt: | HCl |
| Smiles: | CC(C)c1ccc(cc1)n1c(C2CCNCC2)c(cn1)C(Nc1cc(ccc1OC)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7045 |
| logD: | 0.2236 |
| logSw: | -3.8262 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.619 |
| InChI Key: | QIBMKGYQTUAHJS-UHFFFAOYSA-N |