홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Pyridine → 4-Bromo-5-fluoro-1-{3-fluoro-4-[(phenylmethyl)oxy]phenyl}-1H-indazole

HRID 2423075
노트
인쇄 미리보기

반응식

HRID 2423075 반응식
[Br:1][C:2]1[C:10]([F:11])=[CH:9][CH:8]=[C:7]2[C:3]=1[CH:4]=[N:5][NH:6]2.[F:12][C:13]1[CH:14]=[C:15](B(O)O)[CH:16]=[CH:17][C:18]=1[O:19][CH2:20][C:21]1[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=1.N1C=CC=CC=1.B(O)O>C([O-])(=O)C.[Cu+2].C([O-])(=O)C>[Br:1][C:2]1[C:10]([F:11])=[CH:9][CH:8]=[C:7]2[C:3]=1[CH:4]=[N:5][N:6]2[C:15]1[CH:16]=[CH:17][C:18]([O:19][CH2:20][C:21]2[CH:22]=[CH:23][CH:24]=[CH:25][CH:26]=2)=[C:13]([F:12])[CH:14]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 1049PyridineHCID 61668Boronic AcidHCID 27377884-Benzyloxy-3-fluorophenylboronic AcidHCID 592729794-Bromo-5-fluoro-1H-indazole

생성물 1

HCID 592729594-Bromo-5-fluoro-1-{3-fluoro-4-[(phenylmethyl)oxy]phenyl}-1H-indazole수율 49.7%

시약·촉매·용매 1

HCID 8895
Cupric acetate
촉매

실험 절차

A mixture of 4-bromo-5-fluoro-1H-indazole (D15) (1.008 g, 4.69 mmol), {3-fluoro-4-[(phenylmethyl)oxy]phenyl}boronic acid 1.730 g, 7.03 mmol), copper(II) acetate (1.277 g, 7.03 mmol) and pyridine (0.758 mL, 0.742 g, 9.38 mmol) were stirred together vigorously under an air atmosphere with powdered 4A molecular sieves (5 g) at room temperature. After 6 days another 580 mg of boronic acid were added and stirring continued for a further 24 hrs. The mixture was filtered through celite, the celite was washed with dichloromethane and the combined filtrate was washed with water, dried over Na2SO4 and evaporated. Chromatography (silica gel, 0-100% dichloromethane in isohexane), followed by trituration of the product with diethyl ether gave the title compound (D16) (0.968 g) as a white solid.

후처리

  1. filtrationThe mixture was filtered through celite
  2. washthe celite was washed with dichloromethane
  3. washthe combined filtrate was washed with water
  4. dry with materialdried over Na2SO4
  5. customevaporated

출처 및 근거

ORD 기록
ord-5178476d3d7c460bb5fc025e7ee1b0d6
출처 데이터셋
uspto-grants-2011_06
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07960563B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트