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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2273083Generated: November 1, 2026

Phosgene → HCID 89714647, compound

https://huagongshe.com/reaction/2273083

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhosgeneHCID 6371—
ReactantDiisopropylethylamineHCID 81531—
Reactant2-Propanol, 1-amino-2-methyl-HCID 95102—
ReactantHCID 89714851HCID 89714851—
SolventWaterHCID 962—
SolventTolueneHCID 1140—
SolventDichloromethaneHCID 6344—
Solvent1,4-DioxaneHCID 31275—
ProductHCID 89714647HCID 8971464752.3%

Reaction Steps

100 mg (226.5 μmol) of 4-(4-amino-3-fluorophenyl)-6-ethyl-8,8-dimethyl-2-(8-oxa-3-azabicyclo[3.2.1]oct-3-yl)-7,8-dihydro-6H-9-oxa-1,3,6-triazabenzocyclohepten-5-one suspended in 2 ml of dioxane are heated at 50° C. for 30 minutes in the presence of 179 μl of a 1.9 M solution of phosgene (339.75 μmol) in toluene and 58 μl (339.5 μmol) of DIEA. 101 mg (1.13 mmol) of 2-hydroxy-2-methylpropylamine dissolved in 1 ml of dioxane are then added. The reaction medium is stirred for 16 hours at room temperature and then diluted with water. The precipitate formed is filtered off and washed with water and then with ether. The solid obtained is dissolved in a minimum amount of DCM and then reprecipitated from ether to give 66 mg of 1-{4-[6-ethyl-8,8-dimethyl-2-(8-oxa-3-azabicyclo[3.2.1]oct-3-yl)-5-oxo-5,6,7,8-tetrahydro-9-oxa-1,3,6-triazabenzocyclohepten-4-yl]-2-fluorophenyl}-3-(2-hydroxy-2-methylpropyl)urea.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09120812B2
Source datasetuspto-grants-2015_09
ORD IDord-f46c8e3659ab4c01ac6b617514bf8d0e
Source noteuspto-grants-2015_09