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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 715055Generated: October 30, 2026

Nitrogen → N-(3-fluoro-4-(4-methylpiperazin-1-yl)phenyl)-1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-5-amine

https://huagongshe.com/reaction/715055

Reaction equation

Participants

RoleNameHCIDCharge
ReactantNitrogenHCID 947—
ReactantBinap, (A+-)-HCID 634876—
Reactant3-Fluoro-4-(4-methylpiperazin-1-yl)anilineHCID 2783055—
Reactant5-bromo-1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridineHCID 57856333—
ReactantHCID 178418922HCID 178418922—
CatalystBis(dibenzylideneacetone)palladiumHCID 9811564—
SolventChloroformHCID 6212—
Solvent1,4-DioxaneHCID 31275—
ProductN-(3-fluoro-4-(4-methylpiperazin-1-yl)phenyl)-1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-5-amineHCID 70811059—

Reaction Conditions

Temperature90 °C

Reaction Steps

A stirred solution of 5-bromo-1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine (7) (100 mg, 0.301 mmol) and 3-fluoro-4-(4-methylpiperazin-1-yl)aniline (168) (77 mg, 0.33 mmol, 1.1 eq) in 1,4-dioxane (10 mL) was degassed and purged with N2 for 10 min. tert-BuOK (101 mg, 0.903 mmol, 3.0 eq) was added and the reaction mixture purged and degassed again. To this reaction mixture was added ±BINAP (8 mg, 0.00301 mmol, 0.01 eq) and Pd2(dba)3 (11 mg, 0.0012 mmol, 0.04 eq) and the resulting reaction was heated at 90° C. for 12 hrs in sealed tube condition. After completion of the reaction the contents were cooled and diluted with CHCl3 and filtered through Celite bed. The CHCl3 layer was completely distilled off to get the crude product. The crude was passed through 100-200 mesh silica gel, eluting the pure compound N-(3-fluoro-4-(4-methylpiperazin-1-yl)phenyl)-1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-5-amine 169 obtained with 6% MeOH in CH2Cl2 as an off-white colored solid in 40 mg quantity.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09187473B2
Source datasetuspto-grants-2015_11
ORD IDord-5f4f542052784662a6efaa514c495589
Source noteuspto-grants-2015_11