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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 409653Erstellt: 25. Oktober 2026

Phosgene → 1-(2,6-Dichloro-3,5-dimethoxy-phenyl)-3-{6-[4-(2-morpholin-4-yl-ethoxy)phenylamino]-pyrimidin-4-yl}-urea

https://huagongshe.com/reaction/409653

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktPhosgeneHCID 6371—
EduktIsocyanateHCID 105034—
EduktSodium BicarbonateHCID 516892—
Edukt2,6-Dichloro-3,5-dimethoxyanilineHCID 59486253—
EduktN-[4-(2-morpholin-4-yl-ethoxy)-phenyl]-pyrimidine-4,6-diamineHCID 59864576—
LösungsmittelDichloromethaneHCID 6344—
LösungsmittelN-methyl-2-pyrrolidoneHCID 13387—
Lösungsmittel1,4-DioxaneHCID 31275—
Produkt1-(2,6-Dichloro-3,5-dimethoxy-phenyl)-3-{6-[4-(2-morpholin-4-yl-ethoxy)phenylamino]-pyrimidin-4-yl}-ureaHCID 23630278—

Reaktionsschritte

Phosgene (20% in toluene, 0.8 mL, 1.58 mmol, 2.4 equiv) is added to a solution of 2,6-dichloro-3,5-dimethoxyaniline (175 mg, 0.79 mmol, 1.2 equiv) in dioxane (2.5 mL), under an argon atmosphere. The mixture is heated to reflux, stirred for 1 h, allowed to cool to RT, and concentrated in vacuo. The resulting isocyanate is added to a solution of N-[4-(2-morpholin-4-yl-ethoxy)-phenyl]-pyrimidine-4,6-diamine (208.5 mg, 0.66 mmol) in NMP (2 mL), at 75° C. and under an argon atmosphere. The reaction mixture is stirred at 75° C. for 2 h, allowed to cool to RT, and is then diluted with DCM and a saturated aqueous solution of NaHCO3. The aqueous layer is separated and extracted with DCM. The organic phase is washed with brine, dried (Na2SO4), filtered and concentrated. Purification of the crude product by silica gel column chromatography (DCM/MeOH+1% NH3aq, 96:4), followed by trituration of the resulting material in MeOH, affords the title compound as a white solid: ESI-MS: 562.9/564.9 [MH]+; tR=2.99 min (purity: 100%, system 1); TLC: Rf=0.36 (DCM/MeOH+1% NH3aq, 93:7).

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08759517B2
Quelldatensatzuspto-grants-2014_06
ORD IDord-043a0c6a124540bdb2566f4e5faa3739
Quellennotizuspto-grants-2014_06