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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2279990Generated: November 2, 2026

Ammonium Chloride → 2-Chloro-9-cyclopentyl-5,7,8,9-tetrahydro-pyrimido[4,5-b][1,4]diazepin-6-one

https://huagongshe.com/reaction/2279990

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAmmonium ChlorideHCID 25517—
ReactantMethyl 3-[cyclopentyl(2-chloro-5-nitropyrimidin-4-yl)amino]propanoateHCID 57940528—
CatalystIronHCID 23925—
SolventWater ethanolHCID 19096565—
Product2-Chloro-9-cyclopentyl-5,7,8,9-tetrahydro-pyrimido[4,5-b][1,4]diazepin-6-oneHCID 5794035943.7%

Reaction Steps

Methyl 3-[cyclopentyl(2-chloro-5-nitropyrimidin-4-yl)amino]propanoate (1.00 g, 0.003 mol) and NH4Cl (1.38 g, 0.025 mol, 8.5 eq) were added to EtOH/H2O (4:1 ml, 10 ml) and the mixture heated to reflux before the portion-wise addition of iron powder (1.36 g, 0.024 mol, 8 eq). The RM was then refluxed for an additional 2 h. Progress of the reaction was monitored by HPLC and when no SM remained the RM was filtered hot through celite. The celite was washed with EtOAc (10 ml) and EtOH (10 ml) [both hot] and the filtrate evaporated under reduced pressure and further dried in vacuo to give the product as a brown solid (350 mg, 43%); Rt=12 min (Vydac 1); MS+ve: 267.2.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09133199B2
Source datasetuspto-grants-2015_09
ORD IDord-a19cbeacbbb641f3b946e40595d11875
Source noteuspto-grants-2015_09