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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1874770생성일: 2026년 10월 27일

Diisopropylethylamine → 2-Chloro-N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]phenyl}methyl)-4-(methylsulfonyl)benzamide

https://huagongshe.com/reaction/1874770

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참여 물질

역할이름HCID투입량
반응물DiisopropylethylamineHCID 81531—
반응물2-Chloro-4-(methylsulfonyl)benzoic acidHCID 735863—
반응물Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 9886157—
반응물3-{[5-(Aminomethyl)-2-chlorophenyl]oxy}-5-chlorobenzonitrileHCID 59451405—
용매DimethylformamideHCID 6228—
생성물2-Chloro-N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]phenyl}methyl)-4-(methylsulfonyl)benzamideHCID 5945162269.2%

반응 단계

2-Chloro-N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]phenyl}methyl)-4-(methylsulfonyl)benzamide was prepared in a similar manner as described herein from 3-{[5-(aminomethyl)-2-chlorophenyl]oxy}-5-chlorobenzonitrile (0.025 g, 0.085 mmol), 2-chloro-4-(methylsulfonyl)benzoic acid, (0.03 g, 0.13 mmol), HATU (0.05 g, 0.13 mmol), DIPEA (0.025 mL, 0.13 mmol) and DMF (1 mL). The crude material was purified by Reverse-Phase HPLC (water/acetonitrile with 0.1% TFA). The desired fractions were neutralized and extracted with EtOAc. The organic extracts were combined, dried over Na2SO4, filtered and evaporated to afford the title compound (0.030 g, 69%) as a white solid. 1H NMR (400 MHz, DMSO-d6): δ ppm 9.20 (t, 1H), 8.02 (d, 1H), 7.92 (dd, 1H), 7.83 (d, 1H), 7.69 (d, 1H), 7.62 (d, 1H), 7.48 (d, 1H), 7.41 (t, 1H), 7.31 (dd, 1H), 7.23 (d, 1H), 4.46 (d, 2H), 3.30 (s, 3H). MS: m/z 508.9 (M+1).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08304419B2
출처 데이터셋uspto-grants-2012_11
ORD IDord-858eae7b3e5a4760894c69cf80af5efb
출처 메모uspto-grants-2012_11