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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 421585Generated: October 31, 2026

Ethanol → HCID 178521598, compound

https://huagongshe.com/reaction/421585

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthanolHCID 702—
ReactantDiisopropylcarbodiimideHCID 12734—
Reactant2,6-Difluorophenyl isothiocyanateHCID 4031601—
ReactantHCID 178508036HCID 178508036—
SolventDimethylformamideHCID 6228—
ProductHCID 178521598HCID 17852159846%

Reaction Steps

4-{[5-Amino-4-(cyclopentylamino)pyrimidin-2-yl]amino}trans-cyclohexan-1-ol (1.13 mmol, 330 mg) was dissolved in DMF (8.5 mL) and 2,6-difluorophenyl-isothiocyanate (1.13 mmol, 0.146 mL) was added. The reaction mixture was stirred at room temperature for about 90 minutes. Ethanol (2.5 mL) was added and the reaction mixture was stirred for about an additional 30 minutes. N,N-Diisopropylcarbodiimide (3.40 mmol, 0.532 mL) was added and the reaction mixture was stirred overnight. Solvent was removed and the residue was purified using column chromatography (SiO2, 1:1 n-hexanes/ethyl acetate→ethyl acetate→1% methanol/ethyl acetate) to give the desired product (222.5 mg, 46% yield). ES-MS: 429 (M+1). Tetrahydrofuran can also be used as solvent in this step.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08101588B2
Source datasetuspto-grants-2012_01
ORD IDord-f8d2605e763b4ade959171d4f21494ed
Source noteuspto-grants-2012_01