4-Amino-1-Boc-piperidine → 4-{[4-(2-Cyclopropylmethoxy-5-fluoro-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carbonyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester

반응식

[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32](=[O:33])[N:34]1[CH2:35][CH2:36][CH:37]([NH2:40])[CH2:38][CH2:39]1.[CH:1]1([CH2:4][O:5][c:6]2[c:7](-[c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[c:21]([C:24](=[O:25])[OH:26])[cH:22][nH:23]4)[cH:8][c:9]([F:14])[c:10]([O:12][CH3:13])[cH:11]2)[CH2:2][CH2:3]1>>[CH:1]1([CH2:4][O:5][c:6]2[c:7](-[c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[c:21]([C:24](=[O:26])[NH:40][CH:37]3[CH2:36][CH2:35][N:34]([C:32]([O:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:33])[CH2:39][CH2:38]3)[cH:22][nH:23]4)[cH:8][c:9]([F:14])[c:10]([O:12][CH3:13])[cH:11]2)[CH2:2][CH2:3]1

참가 물질

반응물 2

HCID 12682914-Amino-1-Boc-piperidine

HCID 668664044-(2-Cyclopropylmethoxy-5-fluoro-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid

생성물 1

HCID 668669834-{[4-(2-Cyclopropylmethoxy-5-fluoro-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carbonyl]-amino}-piperidine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록: ord-ede4cfe6025643fea668e9dad6959157
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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