2,3-Dimethylpyridine-5-boronic acid pinacol ester → 4-(2-(5,6-Dimethylpyridin-3-yl)-6-((4-(methylsulfonyl)piperazin-1-yl)methyl)thieno[2,3-d]pyrimidin-4-yl)morpholine

HRID 87437

반응식

HRID 87437 반응식
[CH3:1][c:2]1[n:3][cH:4][c:5]([B:9]2[O:10][C:11]([CH3:12])([CH3:13])[C:14]([CH3:15])([CH3:16])[O:17]2)[cH:6][c:7]1[CH3:8].[Cl:18][c:19]1[n:20][c:21]([N:39]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[c:22]2[c:23]([n:24]1)[s:25][c:26]([CH2:28][N:29]1[CH2:30][CH2:31][N:32]([S:35](=[O:36])(=[O:37])[CH3:38])[CH2:33][CH2:34]1)[cH:27]2>>[CH3:1][c:2]1[n:3][cH:4][c:5](-[c:19]2[n:20][c:21]([N:39]3[CH2:40][CH2:41][O:42][CH2:43][CH2:44]3)[c:22]3[c:23]([n:24]2)[s:25][c:26]([CH2:28][N:29]2[CH2:30][CH2:31][N:32]([S:35](=[O:36])(=[O:37])[CH3:38])[CH2:33][CH2:34]2)[cH:27]3)[cH:6][c:7]1[CH3:8]

참가 물질

3

반응물 2

HCID 532168102,3-Dimethylpyridine-5-boronic acid pinacol esterHCID 568339462-Chloro-6-((4-(methylsulfonyl)piperazin-1-yl)methyl)-4-morpholinothieno[2,3-d]pyrimidine

생성물 1

HCID 249470524-(2-(5,6-Dimethylpyridin-3-yl)-6-((4-(methylsulfonyl)piperazin-1-yl)methyl)thieno[2,3-d]pyrimidin-4-yl)morpholine

출처 및 근거

ORD 기록
ord-e31875f9574b4675885f92ff49a560f5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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