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4-Aminopyridine → HCID 59624858, 화합물

HRID 1943437
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HRID 1943437 반응식
[Cl:1][C:2]1[CH:3]=[C:4]([N:14]([CH2:22][C:23]2[CH:28]=[CH:27][C:26]([O:29][CH3:30])=[CH:25][CH:24]=2)[C:15]2[CH:20]=[CH:19][C:18]([CH3:21])=[CH:17][N:16]=2)[C:5]2[N:6]([C:8]([C:11]([OH:13])=O)=[CH:9][N:10]=2)[N:7]=1.Cl.CN(C)CCCN=C=NCC.ON1C2C=CC=CC=2N=N1.[N:53]1[CH:58]=[CH:57][C:56]([NH2:59])=[CH:55][CH:54]=1>C(#N)C>[Cl:1][C:2]1[CH:3]=[C:4]([N:14]([CH2:22][C:23]2[CH:28]=[CH:27][C:26]([O:29][CH3:30])=[CH:25][CH:24]=2)[C:15]2[CH:20]=[CH:19][C:18]([CH3:21])=[CH:17][N:16]=2)[C:5]2[N:6]([C:8]([C:11]([NH:59][C:56]3[CH:57]=[CH:58][N:53]=[CH:54][CH:55]=3)=[O:13])=[CH:9][N:10]=2)[N:7]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 17274-AminopyridineHCID 757711-HydroxybenzotriazoleHCID 27239391,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 59624777HCID 59624777, 화합물

생성물 1

HCID 59624858HCID 59624858, 화합물수율 38.8%

시약·촉매·용매 1

HCID 6342
Acetonitrile
용매

실험 절차

A solution of 6-chloro-8-((4-methoxybenzyl)(5-methylpyridin-2-yl)amino)imidazo[1,2-b]pyridazine-3-carboxylic acid (0.07 g, 0.165 mmol), 1-(3-(dimethylamino)propyl)-3-ethylcarbodiimide hydrochloride (0.047 g, 0.248 mmol), 1-hydroxybenzotriazole (0.033 g, 0.248 mmol), TEA (0.069 mL, 0.495 mmol) and pyridin-4-amine (0.023 g, 0.248 mmol) in acetonitrile (2 mL) was heated to 80° C. for 16 hours. The solution was quenched with EA/water. The organic layer was washed with sat NaHCO3 and sat NaCl. The organic layer was dried with Na2SO4, filtered and concentrated in vacuo to give the crude product mixture. The crude product was purified by ISCO (5% EtOAC/DCM; 12 g column), followed by ISCO (5% MeOH/DCM; 12 g column) to afford the title compound (32 mg). [M+H]=500.

후처리

  1. customThe solution was quenched with EA/water
  2. washThe organic layer was washed with sat NaHCO3
  3. dry with materialThe organic layer was dried with Na2SO4
  4. filtrationfiltered
  5. concentrationconcentrated in vacuo
  6. customto give the crude product mixture
  7. customThe crude product was purified by ISCO (5% EtOAC/DCM; 12 g column)

출처 및 근거

ORD 기록
ord-88ed22ca373048f79c5e14a41beb4674
출처 데이터셋
uspto-grants-2013_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08389527B2

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