Bromobenzene → 2-(cyclohexylmethyl)-5-(3-fluoro-4-(3-iodo-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl)-3-methylpyrimidin-4(3H)-one
Reaction equation
[Br:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[CH3:44][N:45]([c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1)[CH3:52].[CH:1]1([CH2:7][c:8]2[n:9][cH:10][c:11](-[c:16]3[cH:17][c:18]([F:23])[c:19]([OH:22])[cH:20][cH:21]3)[c:12](=[O:15])[n:13]2[CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:24][c:25]1[c:26]2[c:27]([n:28][cH:29][cH:30]1)[n:31]([CH2:35][c:36]1[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]1)[n:32][c:33]2[I:34]>>[CH:1]1([CH2:7][c:8]2[n:9][cH:10][c:11](-[c:16]3[cH:17][c:18]([F:23])[c:19]([O:22][c:25]4[c:26]5[c:27]([n:28][cH:29][cH:30]4)[n:31]([CH2:35][c:36]4[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]4)[n:32][c:33]5[I:34])[cH:20][cH:21]3)[c:12](=[O:15])[n:13]2[CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-be42b410afc04b1485148076b564fb0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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