Hydrochloric Acid → 1-[4-(4-chloro-5-ethoxy-2-fluorophenyl)piperazin-1-yl]-2-[3-(1H-imidazol-2-yl)pyrazolo[3,4-b]pyridin-1-yl]ethanone
Reaction equation
[Cl:45][c:46]1[cH:47][c:48]([F:61])[c:49]([N:55]2[CH2:56][CH2:57][NH:58][CH2:59][CH2:60]2)[cH:50][c:51]1[O:52][CH2:53][CH3:54].[ClH:43].[ClH:44].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1.[nH:25]1[c:26](-[c:30]2[n:31][n:32]([CH2:39][C:40](=[O:41])[OH:42])[c:33]3[n:34][cH:35][cH:36][cH:37][c:38]23)[n:27][cH:28][cH:29]1>>[nH:25]1[c:26](-[c:30]2[n:31][n:32]([CH2:39][C:40](=[O:42])[N:58]3[CH2:57][CH2:56][N:55]([c:49]4[c:48]([F:61])[cH:47][c:46]([Cl:45])[c:51]([O:52][CH2:53][CH3:54])[cH:50]4)[CH2:60][CH2:59]3)[c:33]3[n:34][cH:35][cH:36][cH:37][c:38]23)[n:27][cH:28][cH:29]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-cf26f929b00e4a83bd7a526e552b6a2e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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