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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 521387Generated: October 30, 2026

Diisopropylethylamine → HCID 67437879, compound

https://huagongshe.com/reaction/521387

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDiisopropylethylamineHCID 81531—
ReactantTert-butyl 1,4-diazepane-1-carboxylateHCID 2756058—
Reactant(5R,7R)-4-chloro-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-yl 4-nitrobenzoateHCID 86651804—
SolventIsopropanolHCID 3776—
ProductHCID 67437879HCID 6743787981%

Reaction Conditions

Temperature80 °C

Reaction Steps

(5R,7R)-4-Chloro-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-yl 4-nitrobenzoate (65 mg, 0.195 mmol) was dissolved in i-PrOH (5 mL), and then tert-butyl 1,4-diazepane-1-carboxylate (51 mg, 0.253 mmol) was added. N,N-Diisopropylethylamine (49 mg, 0.350 mmol) was added, and the reaction mixture was heated to 80° C. for 12 hours, after which the solvents were removed under reduced pressure. The resulting residue was taken up into EtOAc and then washed twice with water and once with brine. The organic portion was dried over magnesium sulfate, filtered, and then concentrated. The resulting residue was purified via silica gel chromatography to give tert-butyl 4-((5R,7R)-5-methyl-7-(4-nitrobenzoyloxy)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)azepane-1-carboxylate (78 mg, 81%). LCMS (APCI+) M+=498.1, Rt=3.81 min.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09328091B2
Source datasetuspto-grants-2016_05
ORD IDord-fcd872330f844dc487a88f9bb0394cfe
Source noteuspto-grants-2016_05