N-[4-(cyanomethyl)phenyl]-1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
N-[4-(cyanomethyl)phenyl]-1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E922-1572 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-1-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 439.92 |
| Molecular Formula: | C23 H22 F N5 O |
| Salt: | HCl |
| Smiles: | C1CNCCC1c1c(cnn1c1cccc(c1)F)C(Nc1ccc(CC#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0796 |
| logD: | -1.4014 |
| logSw: | -2.9133 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.797 |
| InChI Key: | FXBUVZHETCKMAK-UHFFFAOYSA-N |