Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2220460Generated: November 1, 2026

Sodium Carbonate → HCID 15950088, compound

https://huagongshe.com/reaction/2220460

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium CarbonateHCID 10340—
ReactantTriphenylphosphineHCID 11776—
Reactant(Pyrimidin-5-yl)boronic acidHCID 2795193—
ReactantHCID 59772744HCID 59772744—
CatalystBis(dibenzylideneacetone)palladiumHCID 9811564—
SolventMethanolHCID 887—
SolventTolueneHCID 1140—
SolventChloroformHCID 6212—
SolventEthyl AcetateHCID 8857—
SolventEthylacetate methanolHCID 21584119—
ProductHCID 15950088HCID 1595008865.2%

Reaction Steps

In a pressure tube was put 2 mL of MeOH and 2 mL of toluene. The solution was degassed with argon and 7.5 mg (0.008 mmol) of Pd2(dba)3 and 8.6 mg of triphenylphosphine was added under an argon atmosphere. After 15 min stirring at room temperature, 47.0 mg (0.38 mmol) of 5-pyrimidyl-boronic acid, 83 mg (0.78 mmol) of Na2CO3, and 125 mg (0.27 mmol) of 4-[2-Amino-4-(3-bromo-4-fluoro-phenyl)-1-methyl-5-oxo-4,5-dihydro-1H-imidazol-4-yl]-1-(2-fluoro-ethyl)-1H-pyrrole-2-carboxylic acid methyl ester was added and the reaction sealed heated to 110° C. for 18 h. The reaction mixture was cooled, diluted with 100 mL of CHCl3, filtered through celite and the solvent removed at reduced pressure. Chromatography on silica gel using a gradient of EtOAc to 2%-8% MeOH-EtOAc yielded 0.08 gm (64% yield) of a white solid (mp 88-90° C.). 1H NMR (500 MHz, CDCl3) δ: 3.15 (s, 3H), 3.73 (s, 3H), 4.50 (m, 1H), 4.58 (m, 2H), 4.68 (m, 1H), 6.96 (s, 2H), 7.16 (t, 1H, J=8.66 Hz), 7.65 (m, 2H), 8.88 (m, 2H), 9.15 (s, 1H). MS (ESI) m/z 455.1 ([M+H])+; MS (ESI) m/z 453.1 ([M−H])−.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07417047B2
Source datasetuspto-grants-2008_08
ORD IDord-dbf851f25a864a458f1c23eb27059c8b
Source noteuspto-grants-2008_08