Trifluoroacetic acid → 5-(6-((4-(Dimethylamino)piperidin-1-yl)methyl)-4-morpholinothieno[3,2-d]pyrimidin-2-yl)imidazo[1,2-a]pyridin-8-ol

반응식

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

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 59605648{1-[2-(8-Benzyloxyimidazo[1,2-a]pyridin-5-yl)-4-morpholin-4-yl-thieno[3,2-d]pyrimidin-6-ylmethyl]piperidin-4-yl}dimethylamine

생성물 1

HCID 1360271385-(6-((4-(Dimethylamino)piperidin-1-yl)methyl)-4-morpholinothieno[3,2-d]pyrimidin-2-yl)imidazo[1,2-a]pyridin-8-ol

출처 및 근거

ORD 기록: ord-0af1429c84224c30b6c6c2e3eaefae70
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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