5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine → 5-{1-[4-Difluoromethyl-6-(6-trifluoromethyl-pyridin-3-yl)-pyrimidin-2-yl]-1H-imidazol-4-yl}-pyridin-2-ylamine

반응식

[I:1][c:2]1[n:3][cH:4][n:5](-[c:7]2[n:8][c:9](-[c:16]3[cH:17][n:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[cH:10][c:11]([CH:13]([F:14])[F:15])[n:12]2)[cH:6]1.[NH2:26][c:27]1[n:28][cH:29][c:30]([B:33]2[O:34][C:35]([CH3:36])([CH3:37])[C:38]([CH3:39])([CH3:40])[O:41]2)[cH:31][cH:32]1>>[c:2]1(-[c:30]2[cH:29][n:28][c:27]([NH2:26])[cH:32][cH:31]2)[n:3][cH:4][n:5](-[c:7]2[n:8][c:9](-[c:16]3[cH:17][n:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[cH:10][c:11]([CH:13]([F:14])[F:15])[n:12]2)[cH:6]1

참가 물질

반응물 2

HCID 27565555-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

HCID 673934282-(4-Iodo-imidazol-1-yl)-4-difluoromethyl-6-(6-trifluoromethyl-pyridin-3-yl)-pyrimidine

생성물 1

HCID 250982735-{1-[4-Difluoromethyl-6-(6-trifluoromethyl-pyridin-3-yl)-pyrimidin-2-yl]-1H-imidazol-4-yl}-pyridin-2-ylamine

출처 및 근거

ORD 기록: ord-ef02bf51bed64ffb84044e584a5ac777
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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