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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1012150Generated: November 3, 2026

Isopropanol → HCID 178514080, compound

https://huagongshe.com/reaction/1012150

Reaction equation

Participants

RoleNameHCIDCharge
ReactantIsopropanolHCID 3776—
ReactantTriethylamineHCID 8471—
Reactant2,4-Difluorophenyl isocyanateHCID 593258—
ReactantHCID 178508054HCID 178508054—
SolventTolueneHCID 1140—
SolventEthyl AcetateHCID 8857—
ProductHCID 178514080HCID 17851408039%

Reaction Conditions

Temperature80 °C

Reaction Steps

A mixture of 3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-ylamine (50 mg, 0.16 mmol), 2,4 difluorophenyl isocyanate (26 mg, 0.16 mmol) and Et3N (0.024 ml) suspended in a mixture of toluene (2 ml) and IPA (1 ml) was stirred at 80° C. for 1 h and then diluted with EtOAc. The reaction mixture was washed with water then brine, organics dried (MgSO4) and reduced in vacuo The residue was purified by flash column chromatography [SiO2, CH2Cl2-MeOH (90:10)] to give 1-(2,6-Difluorophenyl)-N-[3-(5-morpholin-4-ylmethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-urea (AT7787) as a colourless solid (30 mg, 39%). (LC/MS (acidic method): Rt 1.80, [M+H]+ 454).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07977477B2
Source datasetuspto-grants-2011_07
ORD IDord-97f7c4db7fed4efeadb47fa23f950230
Source noteuspto-grants-2011_07