2,4-Dimethoxypyrimidine-5-boronic acid pinacol ester → 4-((2-(2,4-dimethoxypyrimidin-5-yl)-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)-N,N-dimethylpiperazine-1-carboxamide

반응식

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

참가 물질

반응물 2

HCID 162183882,4-Dimethoxypyrimidine-5-boronic acid pinacol ester

HCID 866235114-(2-Chloro-4-morpholin-4-yl-thieno[3,2-d]pyrimidin-6-ylmethyl)-piperazine-1-carboxylic acid dimethylamide

생성물 1

HCID 249470474-((2-(2,4-dimethoxypyrimidin-5-yl)-4-morpholinothieno[3,2-d]pyrimidin-6-yl)methyl)-N,N-dimethylpiperazine-1-carboxamide

출처 및 근거

ORD 기록: ord-f45269ef97ba42c19b1330a323869273
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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