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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 888440Generated: October 31, 2026

Cesium carbonate → (S)-(+)-N-(3-(6-(4-(2-(Dimethylamino)-1-(isopropyl(methyl)amino)-2-oxoethyl)phenylamino)-4-methyl-5-oxo-4,5-dihydropyrazin-2-yl)-2-methylphenyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamide

https://huagongshe.com/reaction/888440

Reaction equation

Participants

RoleNameHCIDCharge
ReactantCesium carbonateHCID 10796—
Reactant1,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)HCID 636044—
ReactantN-(3-(6-Bromo-4-methyl-5-oxo-4,5-dihydropyrazin-2-yl)-2-methylphenyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamideHCID 57625151—
Reactant(S)-2-(4-Aminophenyl)-2-(isopropyl(methyl)amino)-N,N-dimethylacetamideHCID 66941034—
CatalystBis(dibenzylideneacetone)palladiumHCID 9811564—
Solvent1,4-DioxaneHCID 31275—
Product(S)-(+)-N-(3-(6-(4-(2-(Dimethylamino)-1-(isopropyl(methyl)amino)-2-oxoethyl)phenylamino)-4-methyl-5-oxo-4,5-dihydropyrazin-2-yl)-2-methylphenyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamideHCID 2523497752%

Reaction Steps

A 15-mL three-neck round-bottomed flask equipped with a magnetic stirrer, nitrogen inlet and reflux condenser was charged with 23 (53 mg, 0.212 mmol), 11 (98 mg, 0.212 mmol), cesium carbonate (152 mg, 0.468 mmol) and 1,4-dioxane (3 mL). After bubbling nitrogen through the resulting solution for 30 minutes, Xantphos (10.4 mg, 0.018 mmol) and tris(dibenzylideneacetone)dipalladium(0) (9.70 mg, 0.010 mmol) were added and the reaction mixture was heated at reflux for 3 h. After this time the reaction was cooled to room temperature, filtered and the filter cake washed with methylene chloride (2×25 mL). The filtrate was then concentrated under reduced pressure and the residue was purified by column chromatography to afford 24 (68 mg, 52%) as a yellow solid: mp 133-134° C.; 1H NMR (500 MHz, DMSO-d6) δ 9.79 (br s, 1H), 9.19 (br s, 1H), 7.93 (d, 2H, J=8.5 Hz), 7.68 (s, 1H), 7.30 (m, 5H), 7.20 (s, 1H), 4.56 (s, 1H), 3.55 (s, 3H), 3.01 (s, 3H), 2.84 (m, 1H), 2.76 (m, 5H), 2.63 (t, 2H, J=5.5 Hz), 2.28 (s, 3H), 2.02 (s, 3H), 1.79 (m, 4H), 0.91 (m, 6H); MS (ESI+) m/z 627.5 (M+H); [α]25D+24.0° (c 0.25, chloroform).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08247550B2
Source datasetuspto-grants-2012_08
ORD IDord-6fcd3348d8c04bae82072b8f89a715b5
Source noteuspto-grants-2012_08