N,N-Dimethyl-1H-benzimidazol-2-amine → N,N-dimethyl-1-(4-morpholino-6-((3-morpholinoazetidin-1-yl)methyl)pyrido[3,2-d]pyrimidin-2-yl)-1H-benzo[d]imidazol-2-amine

반응식

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

참가 물질

반응물 2

HCID 17846N,N-Dimethyl-1H-benzimidazol-2-amine

HCID 584050304-(1-((2-Chloro-4-morpholinopyrido[3,2-d]pyrimidin-6-yl)methyl)azetidin-3-yl)morpholine

생성물 1

HCID 53377617N,N-dimethyl-1-(4-morpholino-6-((3-morpholinoazetidin-1-yl)methyl)pyrido[3,2-d]pyrimidin-2-yl)-1H-benzo[d]imidazol-2-amine

출처 및 근거

ORD 기록: ord-01afe8581d804d29a56548951e584f1c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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