N-(2-fluoro-5-nitrophenyl)-1-(3-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(2-fluoro-5-nitrophenyl)-1-(3-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-(2-fluoro-5-nitrophenyl)-1-(3-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-0486 |
| Compound Name: | N-(2-fluoro-5-nitrophenyl)-1-(3-methylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 459.91 |
| Molecular Formula: | C22 H22 F N5 O3 |
| Salt: | HCl |
| Smiles: | Cc1cccc(c1)n1c(C2CCNCC2)c(cn1)C(Nc1cc(ccc1F)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.309 |
| logD: | 3.309 |
| logSw: | -3.4678 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.989 |
| InChI Key: | GTNNKYQCWJRNNI-UHFFFAOYSA-N |