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HRID 2056928作成日:2026年10月26日

1,2-Dichloro-4-(isocyanatomethyl)benzene → N-[3-fluoro-4-(trifluoromethyl)benzyl]-2-(5-isoquinolinyl)butanamide

https://huagongshe.com/reaction/2056928

反応式

関与物質

役割名称HCID仕込み量
反応物1,2-Dichloro-4-(isocyanatomethyl)benzeneHCID 2733368—
反応物3-Fluoro-4-(trifluoromethyl)benzylamineHCID 2737567—
反応物2-(Isoquinolin-5-YL)acetic acidHCID 12018708—
反応物2-(Isoquinolin-5-yl)butanoic acidHCID 22337682—
生成物N-[3-fluoro-4-(trifluoromethyl)benzyl]-2-(5-isoquinolinyl)butanamideHCID 22032635—

反応手順

The title compound was prepared using the procedure described in Example 222B using 3-fluoro-4-(trifluoromethyl)benzylamine and 2-(5-isoquinolinyl)butanoic acid instead of 4-(trifluoromethoxy)benzylamine and 5-isoquinolinylacetic acid. MS (ESI+) m/z 391 (M+H)+; MS (ESI−) m/z 389 (M−H)−; 1H NMR (DMSO, 300 MHz) δ 0.91 (t, J 7.5, 3H), 1.81 (m, 1H), 2.17 (m, 1H), 4.35 (m, 2H), 7.17 (m, 2H), 7.69 (t, J 7.8, 1H), 7.86 (t, J 7.8, 1H), 8.04 (d, J 7.1, 1H), 8.23 (d, J 8.1, 1H), 8.65 (d, J 6.8, 1H), 8.83 (t, J 6.8, 1H), 9.60 (s, 1H); Anal. Calcd for C21H18F4N2O+1 HCl: C, 54.77; H, 3.80; N, 5.55. Found: C, 54.62; H, 3.57; N, 5.50.

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US07335678B2
出典データセットuspto-grants-2008_02
ORD IDord-3f1fa90e5bb94223a9de3681a80f350f
出典メモuspto-grants-2008_02