Trifluoroacetic acid → N-(2-chloro-5-fluoro-4-(3-(1-methylpiperidin-4-ylamino)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl)-2-(4-fluorophenyl)-3-oxo-2,3-dihydropyridazine-4-carboxamide
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10]([NH:43][CH:44]3[CH2:45][CH2:46][N:47]([CH3:50])[CH2:48][CH2:49]3)[c:11]3[c:12]2[n:13][cH:14][cH:15][c:16]3[O:17][c:18]2[cH:19][c:20]([Cl:42])[c:21]([NH:25][C:26](=[O:27])[c:28]3[c:29](=[O:41])[n:30](-[c:34]4[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]4)[n:31][cH:32][cH:33]3)[cH:22][c:23]2[F:24])[cH:51][cH:52]1.[F:53][C:54]([F:55])([F:56])[C:57]([OH:58])=[O:59]>>[nH:8]1[n:9][c:10]([NH:43][CH:44]2[CH2:45][CH2:46][N:47]([CH3:50])[CH2:48][CH2:49]2)[c:11]2[c:12]1[n:13][cH:14][cH:15][c:16]2[O:17][c:18]1[cH:19][c:20]([Cl:42])[c:21]([NH:25][C:26](=[O:27])[c:28]2[c:29](=[O:41])[n:30](-[c:34]3[cH:35][cH:36][c:37]([F:40])[cH:38][cH:39]3)[n:31][cH:32][cH:33]2)[cH:22][c:23]1[F:24]Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-df9b7fa645de4afe89d1fc7d902d2def
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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