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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1773383Generated: November 1, 2026

Trifluoroacetic acid → Entrectinib

https://huagongshe.com/reaction/1773383

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTrifluoroacetic acidHCID 6422—
ReactantTetrahydro-4H-pyran-4-oneHCID 121599—
ReactantTetramethylammonium Triacetoxyborohydride (>90%)HCID 13696215—
Reactant2-Amino-N-(5-(3,5-difluorobenzyl)-1H-indazol-3-yl)-4-(4-methylpiperazin-1-yl)benzamideHCID 25175860—
SolventDichloromethaneHCID 6344—
ProductEntrectinibHCID 2514109272.2%

Reaction Steps

To a solution of 2-amino-N-[5-(3,5-difluoro-benzyl)-1H-indazol-3-yl]-4-(4-methyl-piperazin-1-yl)-benzamide (1.9 g, 3.98 mmol) in dichloromethane (80 mL) were added tetrahydro-pyran-4-one (0.55 mL, 5.98 mmol), trifluoroacetic acid (4 mL) and tetramethylammonium triacetoxyborohydride (1.57 g, 5.98 mmol). The mixture was stirred at room temperature overnight, and then more tetramethylammonium triacetoxyborohydride (1.57 g) was added. After stirring for additional 3 hours at room temperature the mixture was diluted with dichloromethane, washed with 2N sodium hydroxide and brine, dried over sodium sulfate and evaporated to dryness. The crude was purified by flash chromatography on silica gel using dichloromethane/methanol/NH3 5N in MeOH 96:4:0.5 as the eluant, affording 1.61 g of the title compound (72% yield).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09255087B2
Source datasetuspto-grants-2016_02
ORD IDord-af9f0823392345cdb5fb5b8ede114776
Source noteuspto-grants-2016_02