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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1796979Generated: November 2, 2026

Hexahydro-1,4-diazepine → HCID 178420600, compound

https://huagongshe.com/reaction/1796979

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHexahydro-1,4-diazepineHCID 68163—
ReactantTris(1,1-dimethylethyl)phosphineHCID 83681—
ReactantSodium t-butoxideHCID 23676156—
ReactantHCID 178419358HCID 178419358—
CatalystPalladiumHCID 23938—
SolventWaterHCID 962—
SolventO-XyleneHCID 7237—
ProductHCID 178420600HCID 178420600—

Reaction Steps

A suspension of 4-bromobenzimidazole (42 mmol), homopiperazine (256 mmol) and NaOt-Bu (59 mmol) in dry o-xylene, under N2, is treated with a catalytic amount of Pd (OCOCH3)2.P(t-Bu)3 (P/Pd=4), heated at 120° C. for 3 hr, cooled to room temperature and diluted with water. The aqueous mixture is extracted with ethyl acetate. The extracts are combined, dried over MgSO4 and concentrated in vacuo to give a residue. The residue is purified by flash chromatography to give 4-(homopiperazin-1-yl)benzimidazole.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07034029B2
Source datasetuspto-grants-2006_04
ORD IDord-3005841839d04c558d230d6f1679a741
Source noteuspto-grants-2006_04