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

Dimethylformamide → (S)-2-(5-(2-(3,4-Dichlorophenyl)acetamido)-1-oxoisoquinolin-2(1H)-yl)propanamide

HRID 1161198
ノート
印刷プレビュー

反応式

HRID 1161198 の反応式
[Cl:1][C:2]1[CH:3]=[C:4]([CH2:9][C:10]([OH:12])=O)[CH:5]=[CH:6][C:7]=1[Cl:8].F[P-](F)(F)(F)(F)F.C[N+](C)=C(N(C)C)ON1C2N=CC=CC=2N=N1.C(N(CC)C(C)C)(C)C.CN(C)C=O.[NH2:51][C:52]1[CH:61]=[CH:60][CH:59]=[C:58]2[C:53]=1[CH:54]=[CH:55][N:56]([C@@H:63]([CH3:67])[C:64]([NH2:66])=[O:65])[C:57]2=[O:62]>>[Cl:1][C:2]1[CH:3]=[C:4]([CH2:9][C:10]([NH:51][C:52]2[CH:61]=[CH:60][CH:59]=[C:58]3[C:53]=2[CH:54]=[CH:55][N:56]([C@@H:63]([CH3:67])[C:64]([NH2:66])=[O:65])[C:57]3=[O:62])=[O:12])[CH:5]=[CH:6][C:7]=1[Cl:8]
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 5

HCID 6228DimethylformamideHCID 798743,4-Dichlorophenylacetic acidHCID 81531DiisopropylethylamineHCID 9886157Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 59515789(S)-2-(5-Amino-1-oxoisoquinolin-2(1H)-yl)propanamide

生成物 1

HCID 59515801
(S)-2-(5-(2-(3,4-Dichlorophenyl)acetamido)-1-oxoisoquinolin-2(1H)-yl)propanamide

実験手順

To a stirred solution of 3,4-dichlorophenyl acetic acid (0.12 g, 0.00056 mol), N,N,N′,N′-tetramethyl-O-(7-azabenzotriazol-1-yl)uronium hexafluorophosphate (0.3 g, 0.0009 mol) and N,N-diisopropylethylamine (0.2 mL, 0.0009 mol) in N,N-dimethylformamide (5 mL, 0.06 mol) was added (S)-2-(5-amino-1-oxoisoquinolin-2(1H)-yl)propanamide (0.10 g, 0.00043 mol). The reaction was stirred for 16 h at room temperature. The reaction was quenched with water, extracted with dichloromethane, washed with 2N HCl, saturated sodium bicarbonate solution, brine and dried over sodium sulfate. The solvent was removed under reduced pressure and the residue was purified by flash chromatography (12 g, 0-10% MeOH/DCM) to yield the product as a white solid.

後処理

  1. customThe reaction was quenched with water
  2. extractionextracted with dichloromethane
  3. washwashed with 2N HCl, saturated sodium bicarbonate solution, brine
  4. dry with materialdried over sodium sulfate
  5. customThe solvent was removed under reduced pressure
  6. customthe residue was purified by flash chromatography (12 g, 0-10% MeOH/DCM)

出典と根拠

ORDレコード
ord-191b786f13184b5dbcc374cc276072ef
出典データセット
uspto-grants-2010_10
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07816371B2

反応ノート

読み込み中…

このページの内容参加物実験手順後処理出典と根拠反応ノート