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

2-Chloropyrimidine → N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrimidin-2-amine

HRID 257
ノート
印刷プレビュー

反応式

HRID 257 の反応式
COc1cc(N)ccc1-n1cnc(C)c1.Clc1ncccn1>CC(=O)O.CC(=O)O.COCCOC.O=C([O-])[O-].[Cs+].[Cs+].[Pd].c1ccc(-c2ccccc2P(C2CCCCC2)C2CCCCC2)cc1>COc1cc(Nc2ncccn2)ccc1-n1cnc(C)c1
参加物反応条件実験手順出典と根拠反応ノート

参加物

7

反応物 2

HCID 744042-ChloropyrimidineHCID 454801813-methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline

生成物 1

HCID 68790359N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrimidin-2-amine収率 18.78%

試薬・触媒・溶媒 4

HCID 10796Cesium carbonate試薬HCID 27342162-(Dicyclohexylphosphino)biphenyl触媒
HCID 4144353
Palladium (II) acetate
触媒
HCID 80711,2-Dimethoxyethane溶媒

反応条件

温度
100 °C

実験手順

2-Chloropyrimidine (0.056 g, 0.49 mmol), 3-methoxy-4-(4-methyl-1H-imidazol-1-yl)aniline (0.100 g, 0.49 mmol), Palladium acetate (0.011 g, 0.05 mmol), 2-(Dicyclohexylphosphino)biphenyl (0.017 g, 0.05 mmol) and Cesium carbonate (0.481 g, 1.48 mmol) were placed in a microwave vial. The mixture was capped and flushed with argon. 1,2-dimethoxyethane (5 mL) was added and the mixture was run in a microwave for 60 minutes at 100°C. Very little product. Added 0.1 eq ligand and palladium acetate, flushed with argon and run in the microwave at 100°C for 60 min. No change. Seems as if the 2-chloropyrimidine is not very soluble in DME. Added 1.5 mL DMF and the reaction was run again in the microwave for 60 minutes. The reaction mixture was filtrated through Celite and washed with dichloromethane. The filtrate was concentrated and the crude product was purified by preparative chromatography. The productcontaining fractions were pooled, concentrated and the residue was partitioned between sat. NaHCO3 (aq) and dichloromethane. The organic layer was separated by a Phase Separator and concentrated giving N-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)pyrimidin-2-amine (0.026 g, 18.78 %).

出典と根拠

ORDレコード
ord-20ba80f324544fc48cbce515702585f3
出典データセット
750 AstraZeneca ELN dataset
元リンク
出典を表示

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出典と根拠反応ノート