Trifluoroacetic acid → N,N-dimethyl-N'-[4-(1-methyl-4-{2-[2-(1-piperazinyl)-5-pyrimidinyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}-1H-pyrazol-3-yl)phenyl]urea

HRID 1180866노트

반응식

HRID 1180866 반응식
[CH3:1][N:2]([CH3:46])[C:3]([NH:5][C:6]1[CH:11]=[CH:10][C:9]([C:12]2[C:16]([C:17]3[CH:22]=[CH:21][N:20]=[C:19]4[NH:23][C:24]([C:26]5[CH:27]=[N:28][C:29]([N:32]6[CH2:37][CH2:36][N:35](C(OC(C)(C)C)=O)[CH2:34][CH2:33]6)=[N:30][CH:31]=5)=[CH:25][C:18]=34)=[CH:15][N:14]([CH3:45])[N:13]=2)=[CH:8][CH:7]=1)=[O:4].FC(F)(F)C(O)=O>ClCCl>[CH3:1][N:2]([CH3:46])[C:3]([NH:5][C:6]1[CH:11]=[CH:10][C:9]([C:12]2[C:16]([C:17]3[CH:22]=[CH:21][N:20]=[C:19]4[NH:23][C:24]([C:26]5[CH:31]=[N:30][C:29]([N:32]6[CH2:37][CH2:36][NH:35][CH2:34][CH2:33]6)=[N:28][CH:27]=5)=[CH:25][C:18]=34)=[CH:15][N:14]([CH3:45])[N:13]=2)=[CH:8][CH:7]=1)=[O:4]

참가 물질

4

반응물 2

HCID 6422Trifluoroacetic acidHCID 689990501,1-dimethylethyl 4-(5-{4-[3-(4-{[(dimethylamino)carbonyl]amino}phenyl)-1-methyl-1H-pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-2-yl}-2-pyrimidinyl)-1-piperazinecarboxylate

생성물 1

HCID 58980065N,N-dimethyl-N'-[4-(1-methyl-4-{2-[2-(1-piperazinyl)-5-pyrimidinyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}-1H-pyrazol-3-yl)phenyl]urea수율 43%

시약·촉매·용매 1

HCID 6344Dichloromethane용매

실험 절차

To a solution of 1,1-dimethylethyl 4-(5-{4-[3-(4-{[(dimethylamino)carbonyl]amino}phenyl)-1-methyl-1H-pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridin-2-yl}-2-pyrimidinyl)-1-piperazinecarboxylate (0.0883 mmol) in dichloromethane (20 ml) was added trifluoroacetic acid (1 ml) and the resulting solution stirred at room temperature for 4 hours. Concentration and purification by reverse-phase HPLC provided the title compound as a yellow solid (43%). ESMS [M+H]+: 523.2

후처리

  1. concentrationConcentration and purification by reverse-phase HPLC

출처 및 근거

ORD 기록
ord-24df44be6c064d31932513938ef277d5
출처 데이터셋
uspto-grants-2007_10
특허 번호
US07282588B2

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