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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 1353892Erstellt: 26. Oktober 2026

Sodium Methoxide → 3-[3-(4-Fluorophenyl)(1h-indazol-5-yl)]-5-(pyrrolidinylmethyl)-1h-1,2,4-triazole

https://huagongshe.com/reaction/1353892

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktSodium MethoxideHCID 10942334—
EduktPyrazoloneHCID 11513733—
EduktPyrrolidine-2-carbohydrazideHCID 14045869—
Eduktethoxy[3-(4fluorophenyl)(1H-indazol-5-yl)]methanimine hydrochlorideHCID 22479739—
LösungsmittelMethanolHCID 887—
Produkt3-[3-(4-Fluorophenyl)(1h-indazol-5-yl)]-5-(pyrrolidinylmethyl)-1h-1,2,4-triazoleHCID 100215355%

Reaktionsschritte

A suspension of ethoxy[3-(4-fluorophenyl)(1H-indazol-5-yl)]methanimine hydrochloride (0.500 g, 1.56 mmol) and N-aminopyrrolidin-2-ylcarboxamide (0.606 g, 4.69 mmol) in 4 mL of anhydrous methanol was prepared. An excess of a commercial solution of sodium methoxide in methanol (0.727 mL, 4.37 M) was added. After 2 h, the temperature was raised to reflux and was maintained for 48 hours. The analysis of the mixture showed the formation of the corresponding oxodiazole occurring as a side reaction. The reaction was then quenched with water, the pH adjusted to neutral and the crude product extracted with ethyl acetate. The title compound was purified by preparative HPLC (0.030 g, 5% yield): 1H NMR (CD3OD) δ 8.69 (t, 1H), 8.10–8.02 (m, 3H), 7.68 (d, 1H), 7.05 (t, 2H), 4.52 (t, 1H), 3.17 (m, 2H), 2.39–1.99 (m, 4H), 2.37 (s, 6H), 2.30 (s, 2H), 1.12 (s, 9H); ES-MS (m/z) 349 [M+H]+.

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS07220771B2
Quelldatensatzuspto-grants-2007_05
ORD IDord-cbb92a8ad5614661ace72bb7bb4ef40b
Quellennotizuspto-grants-2007_05