Trifluoroacetic acid → 5-(3-fluoro-4-(3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl)-3-methyl-2-(phenylamino)pyrimidin-4(3H)-one
Reaction equation
[F:1][c:2]1[cH:3][c:4](-[c:34]2[c:35](=[O:48])[n:36]([CH3:47])[c:37]([NH:40][c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[n:38][cH:39]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[n:15]([CH2:25][c:26]1[cH:27][cH:28][c:29]([O:30][CH3:31])[cH:32][cH:33]1)[n:16][c:17]2-[c:18]1[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]1.[F:49][C:50]([F:51])([F:52])[C:53]([OH:54])=[O:55]>>[F:1][c:2]1[cH:3][c:4](-[c:34]2[c:35](=[O:48])[n:36]([CH3:47])[c:37]([NH:40][c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[n:38][cH:39]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[nH:15][n:16][c:17]2-[c:18]1[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-4502b1a413c744bab26565cbfe75fd94
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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