Hydrogen Bromide → 5-Ethyl-2-fluoro-4-[3-(5-quinolin-3-ylmethyl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol

반응식

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

참가 물질

반응물 3

HCID 260Hydrogen Bromide3회

HCID 836413-Quinolinecarboxaldehyde

HCID 178436901HCID 178436901, 화합물

생성물 1

HCID 1784369135-Ethyl-2-fluoro-4-[3-(5-quinolin-3-ylmethyl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol

출처 및 근거

ORD 기록: ord-f290d4cefbde4f5cb64f07eca2fe433b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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