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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1936731Generated: October 30, 2026

Phosphorus oxychloride → 5-Benzyloxy-4-methoxy-2-{1-[4-(morpholinecarbonyl)-1,4-diazepan-1-yl]ethylideneamino}benzonitrile

https://huagongshe.com/reaction/1936731

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhosphorus oxychlorideHCID 24813—
Reactant2-Amino-5-(benzyloxy)-4-methoxybenzonitrileHCID 11075994—
Reactant1-Acetyl-4-(4-morpholinecarbonyl)-1,4-diazepaneHCID 15538286—
SolventDichloromethaneHCID 6344—
Product5-Benzyloxy-4-methoxy-2-{1-[4-(morpholinecarbonyl)-1,4-diazepan-1-yl]ethylideneamino}benzonitrileHCID 53652588—

Reaction Steps

Phosphorous oxychloride (0.81 ml, 0.0086 mol) was added to a solution of 1-acetyl-4-(4-morpholinecarbonyl)-1,4-diazepane (4.02 g, 0.0157 mol) in dichloromethane (25 ml) and the mixture stirred for 30 minutes at room temperature. A solution of 2-amino-5-benzyloxy-4-methoxybenzonitrile (2 g, 0.0078 mol) in dichloromethane (25 ml) was then added and the reaction stirred for 18 hours at 40° C. On cooling, the reaction mixture was poured carefully in to ice/water (100 ml) and extracted with dichloromethane (2×100 ml). The combined organic layers were dried (MgSO4), filtered and evaporated under reduced pressure to give a brown oil. The crude product was purified on silica gel eluting with a solvent gradient of methanol:dichloromethane (2:98 to 10:90 v/v) to give the subtitle compound. Rf 0.67 (0.880 aqueous ammonia:methanol:dichloromethane 1:7:92, v/v). MS m/z 492 (MH)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06391872B1
Source datasetuspto-grants-2002_05
ORD IDord-b893731e78bb4b1b93e590a5d9f7dfef
Source noteuspto-grants-2002_05