ホームMCPワークベンチSkills
ホームワークベンチ通知マイページ
llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
  1. ホーム
  2. /反応

Water → 6-(6-Chloro-pyrimidin-4-yloxy)-isoquinoline-1-carboxylic acid [5-tert-butyl-2-(4-methoxy-phenyl)-2H-pyrazol-3-yl]-amide

HRID 1094527
ノート
印刷プレビュー

反応式

HRID 1094527 の反応式
[Cl:1][C:2]1[N:7]=[CH:6][N:5]=[C:4]([O:8][C:9]2[CH:10]=[C:11]3[C:16](=[CH:17][CH:18]=2)[C:15]([C:19](Cl)=[O:20])=[N:14][CH:13]=[CH:12]3)[CH:3]=1.N1C=CC=CC=1.[C:28]([C:32]1[CH:33]=[C:34]([NH2:45])[N:35]([C:37]2[CH:42]=[CH:41][C:40]([O:43][CH3:44])=[CH:39][CH:38]=2)[N:36]=1)([CH3:31])([CH3:30])[CH3:29].O>C(Cl)Cl>[C:28]([C:32]1[CH:33]=[C:34]([NH:45][C:19]([C:15]2[C:16]3[C:11](=[CH:10][C:9]([O:8][C:4]4[CH:3]=[C:2]([Cl:1])[N:7]=[CH:6][N:5]=4)=[CH:18][CH:17]=3)[CH:12]=[CH:13][N:14]=2)=[O:20])[N:35]([C:37]2[CH:42]=[CH:41][C:40]([O:43][CH3:44])=[CH:39][CH:38]=2)[N:36]=1)([CH3:31])([CH3:29])[CH3:30]
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 962WaterHCID 1049PyridineHCID 111393953-(tert-Butyl)-1-(4-methoxyphenyl)-1H-pyrazol-5-amineHCID 866386226-(6-Chloro-pyrimidin-4-yloxy)-isoquinoline-1-carbonyl chloride

生成物 1

HCID 866386216-(6-Chloro-pyrimidin-4-yloxy)-isoquinoline-1-carboxylic acid [5-tert-butyl-2-(4-methoxy-phenyl)-2H-pyrazol-3-yl]-amide

試薬・触媒・溶媒 1

HCID 6344Dichloromethane溶媒2 回

反応条件

温度
0 °C

実験手順

454.6 mg (1.42 mMol) 6-(6-Chloropyrimidin-4-yloxy)-isoquinoline-1-carbonyl chloride is dissolved in 10 ml CH2Cl2 and cooled to 0° C. At this temperature 0.46 ml (5.9 mMol) pyridine are added followed by 418.0 mg (1.7 mMol) 5-tert-butyl-2-(4-methoxy-phenyl)-2H-pyrazol-3-ylamine (Step 19.1). The reaction mixture is then allowed to warm to rt and stirred at ambient temperature for 1 h. It is worked up by addition of H2O and CH2Cl2. The organic layer is separated washed with brine and dried. After evaporation of the solvents the crude product is purified by chromatography (combi-flash: 40 g column, hexanes/EtOAc, gradient 0-50% EtOAc) to give the title compound as a yellow solid: m.p.: 156° C.; MS.

後処理

  1. temperatureto warm to rt
  2. customThe organic layer is separated
  3. washwashed with brine
  4. customdried
  5. customAfter evaporation of the solvents the crude product
  6. customis purified by chromatography (combi-flash: 40 g column, hexanes/EtOAc, gradient 0-50% EtOAc)

出典と根拠

ORDレコード
ord-b8ea4dd83ead4dfcb9277975ae7ea8bb
出典データセット
uspto-grants-2012_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08133886B2

反応ノート

読み込み中…

このページの内容参加物反応条件実験手順後処理出典と根拠反応ノート