1-(3-chloro-4-methylphenyl)-N-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-(3-chloro-4-methylphenyl)-N-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
1-(3-chloro-4-methylphenyl)-N-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | C614-5372 |
Compound Name: | 1-(3-chloro-4-methylphenyl)-N-(3-fluorophenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carboxamide--hydrogen chloride (1/1) |
Molecular Weight: | 449.35 |
Molecular Formula: | C22 H22 Cl F N4 O |
Salt: | HCl |
Smiles: | Cc1ccc(cc1[Cl])n1c(C2CCNCC2)c(cn1)C(Nc1cccc(c1)F)=O |
Stereo: | ACHIRAL |
logP: | 3.9798 |
logD: | 0.4988 |
logSw: | -4.3614 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 48.305 |
InChI Key: | KSZHAWWUUVQXMT-UHFFFAOYSA-N |