Pyridine → Pyrazolo[3,4-d]pyrimidine 11

반응식

[C:33]([CH2:34][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)(=[O:42])[Cl:43].[NH2:1][c:2]1[c:3]([O:31][CH3:32])[cH:4][c:5](-[c:8]2[n:9][n:10]([CH:18]3[CH2:19][CH2:20][CH:21]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[CH2:22][CH2:23]3)[c:11]3[n:12][cH:13][n:14][c:15]([NH2:17])[c:16]23)[cH:6][cH:7]1.[cH:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1>>[NH:1]([c:2]1[c:3]([O:31][CH3:32])[cH:4][c:5](-[c:8]2[n:9][n:10]([CH:18]3[CH2:19][CH2:20][CH:21]([N:24]4[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]4)[CH2:22][CH2:23]3)[c:11]3[n:12][cH:13][n:14][c:15]([NH2:17])[c:16]23)[cH:6][cH:7]1)[C:33]([CH2:34][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)=[O:42]

참가 물질

반응물 3

HCID 1049Pyridine

HCID 64801Benzenepropanoyl chloride

HCID 208170343-(4-amino-3-methoxyphenyl)-1-[4-(4-methylpiperazino)-cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

생성물 1

HCID 6539962Pyrazolo[3,4-d]pyrimidine 11

출처 및 근거

ORD 기록: ord-5c739730db2f484bbac08e09ff0c3b58
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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