Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2228317Generated: October 31, 2026

Diethyl cyanophosphonate → N-[4-[(pyrid-2-yl)aminomethyl]phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

https://huagongshe.com/reaction/2228317

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDiethyl cyanophosphonateHCID 76257—
ReactantSodium BicarbonateHCID 516892—
Reactant7-(4-Methylphenyl)-2,3-dihydrobenzooxepine-4-carboxylic acidHCID 10564699—
ReactantN-(4-aminobenzyl)-N-(2-pyridinyl)amineHCID 11788863—
Catalyst4-(Dimethylamino)pyridineHCID 14284—
SolventDimethylformamideHCID 6228—
SolventTriethylamineHCID 8471—
ProductN-[4-[(pyrid-2-yl)aminomethyl]phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamideHCID 1847253221%

Reaction Steps

To a solution of 7-(4-methylphenyl)-2,3-dihydrobenzoxepine-4-carboxylic acid (280 mg) and 2-[(4-aminophenyl)methylamino]pyridine (199 mg) in DMF (4 ml) was added, under ice-cooling, diethyl cyanophosphate (0.18 ml) and triethylamine (0.17 ml), and the mixture was stirred at 0° C. for 30 minutes and then at room temperature for 1 hour. To the mixture was added DMAP (1 piece), and the mixture was stirred at room temperature for 18 hours. Under ice-cooling, to the mixture was added sodium bicarbonate solution, and the mixture was extracted with ethyl acetate, washed with brine, dried (anhydrous magnesium sulfate) and concentrated. The residue was purified with silica gel column chromatography (ethyl acetate/hexane=1/1) and recrystallized from ethyl acetate/hexane to give N-[4-[(pyrid-2-yl)aminomethyl]phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide (Compound 72) (97 mg) as colorless crystals.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06413947B1
Source datasetuspto-grants-2002_07
ORD IDord-a67b40fcc1314b27964adf8bb1fff007
Source noteuspto-grants-2002_07