Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2275494Generated: October 31, 2026

Water → HCID 178459164, compound

https://huagongshe.com/reaction/2275494

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantSodium CarbonateHCID 10340—
Reactant(5-Chloro-2-fluoro-phenyl)boronic acidHCID 3718925—
ReactantHCID 178459152HCID 178459152—
CatalystHCID 178418397HCID 178418397—
Solvent1,4-DioxaneHCID 31275—
ProductHCID 178459164HCID 1784591644.7%

Reaction Conditions

Temperature90 °C

Reaction Steps

(2S,4R)-5-(4-bromophenyl)-2-hydroxymethyl-2-methyl-4-[(1H-[1,2,3]triazole-4-carbonyl)amino]pentanoic acid (38 mg, 92 μmol) was combined with 5-chloro-2-fluorophenylboronic acid (32.2 mg, 185 μmol), sodium carbonate (29.4 mg, 277 μmol), water (0.2 mL) and dioxane (1.5 mL). The reaction vessel was sealed, air was removed by vacuum, and the vessel was purged with nitrogen. Tetrakis(triphenylphosphine)palladium(0) (21.4 mg, 18 μmol) was quickly added and air was removed by vacuum. The mixture was heated at 90° C. for 45 minutes. The mixture was acidified to pH ˜3 and filtered, and the solvate was concentrated. The residue was dissolved in AcOH (0.7 mL) and purified by preparative HPLC to yield the title compound (2 mg). MS m/z [M+H]+ calc'd for C22H22ClFN4O4, 461.13. found 461.2.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09126956B2
Source datasetuspto-grants-2015_09
ORD IDord-0fef0b28d55445eb9d2b685dfc603c6e
Source noteuspto-grants-2015_09