Azetidine → 4-(Azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid (5-morpholin-4-yl-2-phenyl-imidazo[1,2-c]pyrimidin-7-yl)-amide

반응식

[CH2:1]1[CH2:2][NH:3][CH2:4]1.[CH3:5][n:6]1[n:7][cH:8][c:9]([C:35](=[O:36])[OH:37])[c:10]1[C:11]([NH:12][c:13]1[cH:14][c:15]2[n:16]([c:17]([N:19]3[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[n:18]1)[cH:25][c:26](-[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[n:27]2)=[O:34]>>[CH2:1]1[CH2:2][N:3]([C:35]([c:9]2[cH:8][n:7][n:6]([CH3:5])[c:10]2[C:11]([NH:12][c:13]2[cH:14][c:15]3[n:16]([c:17]([N:19]4[CH2:20][CH2:21][O:22][CH2:23][CH2:24]4)[n:18]2)[cH:25][c:26](-[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[n:27]3)=[O:34])=[O:36])[CH2:4]1

참가 물질

반응물 2

HCID 10422Azetidine

HCID 670422821-Methyl-5-(5-morpholin-4-yl-2-phenyl-imidazo[1,2-c]pyrimidin-7-ylcarbamoyl)-1H-pyrazole-4-carboxylic acid

생성물 1

HCID 510349164-(Azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid (5-morpholin-4-yl-2-phenyl-imidazo[1,2-c]pyrimidin-7-yl)-amide

출처 및 근거

ORD 기록: ord-0361251780b34a24b949275c616f8f0f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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