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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1664596Generated: October 29, 2026

Phenyl isocyanate → HCID 57600239, compound

https://huagongshe.com/reaction/1664596

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhenyl isocyanateHCID 7672—
ReactantHCID 57600276HCID 57600276—
SolventWaterHCID 962—
SolventDimethylformamideHCID 6228—
SolventAcetonitrileHCID 6342—
ProductHCID 57600239HCID 5760023980%

Reaction Steps

A mixture of 3-(2-aminoethyl)-7-bromo-9-pentyl-6,9-dihydro-5H-[1,2,4]triazolo[4,3-a]purin-5-one (62 mg, 0.17 mmol) and phenyl isocyanate (0.018 mL, 0.16 mmol) in DMF (5 mL) was stirred at room temperature overnight. The reaction mixture was diluted with water and acetonitrile and then purified by preparative LCMS to give the desired product (about 80% conversion). LCMS calculated for C20H24BrN8O2 (M+H): 487.1; 489.1. found: 487.0, 489.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08039478B2
Source datasetuspto-grants-2011_10
ORD IDord-a5f01231655340f99345756a4508d28e
Source noteuspto-grants-2011_10