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HRID 1502318作成日:2026年10月27日

Bromodifluoromethyl diethylphosphonate → N-(7-(Difluoromethoxy)isoquinolin-3-yl)cyclopropanecarboxamide

https://huagongshe.com/reaction/1502318

反応式

関与物質

役割名称HCID仕込み量
反応物Bromodifluoromethyl diethylphosphonateHCID 144101—
反応物N-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamideHCID 67975011—
溶媒Ethyl AcetateHCID 8857—
溶媒Acetonitrile--water (1/1)HCID 18373917—
生成物N-(7-(Difluoromethoxy)isoquinolin-3-yl)cyclopropanecarboxamideHCID 6797673338.5%

反応条件

温度-78 °C

反応手順

A solution of N-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamide (91.2 mg, 0.40 mmol), diethyl bromodifluoromethylphosphonate (212 mg, 0.80 mmol) in acetonitrile/water (1:1, 5 mL) was mixed and stirred at −78° C. After the reaction mixture was warmed to room temperature and stirred for 20 minutes, the reaction mixture was diluted with ethyl acetate, and the organic phase was separated. The water phase was extracted with ethyl acetate, and the combined organic layer was dried, concentrated and purified by prep-HPLC to give product (42.8 mg, 26%). LCMS (ESI): RT (min)=0.994, M+H+=279.0, method=A. 1H NMR (400 MHz, DMSO-d6) δ 8.92 (s, 1H), 8.54 (s, 1H), 8.37 (s, 1H), 7.79 (d, J=8.8 Hz, 1H), 7.54 (s, 1H), 7.43 (dd, J=2.4, 8.8 Hz, 1H), 6.61 (t, J=73.2 Hz, 1H), 1.71-1.57 (m, 1H), 1.15-1.11 (m, 2H), 0.95-0.89 (m, 2H).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US09206175B2
出典データセットuspto-grants-2015_12
ORD IDord-0bbbeff3f63a4a57a25309ee8e400795
出典メモuspto-grants-2015_12