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

HRID 675019Notes

Reaction equation

HRID 675019 reaction equation
[BrH:16].[BrH:17].[BrH:18].[CH2:19]([CH3:20])[c:21]1[c:22](-[c:29]2[cH:30][cH:31][c:32]3[c:33](-[c:38]4[nH:39][c:40]5[c:41]([n:46]4)[CH2:42][NH:43][CH2:44][CH2:45]5)[n:34][nH:35][c:36]3[cH:37]2)[cH:23][c:24]([F:28])[c:25]([OH:27])[cH:26]1.[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([CH:14]=[O:15])[cH:12][n:13]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([CH2:14][N:43]2[CH2:42][c:41]3[c:40]([nH:39][c:38](-[c:33]4[c:32]5[cH:31][cH:30][c:29](-[c:22]6[c:21]([CH2:19][CH3:20])[cH:26][c:25]([OH:27])[c:24]([F:28])[cH:23]6)[cH:37][c:36]5[nH:35][n:34]4)[n:46]3)[CH2:45][CH2:44]2)[cH:12][n:13]1

Participants

4

Reactant 3

HCID 260Hydrogen Bromide3×HCID 27765006-PhenoxynicotinaldehydeHCID 178436901HCID 178436901, compound

Product 1

HCID 1784369105-Ethyl-2-fluoro-4-{3-[5-(6-phenoxy-pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-6-yl}-phenol

Sources & evidence

ORD record
ord-ef983faa0d124382ac5668dc1a71f616
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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