Bicarbonate Ion → 2-allyl-6-{[3-hydroxymethyl-4-(4-methylpiperazin-1-yl)phenyl]amino}-1-pyridin-2-yl-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
Reaction equation
[CH2:12]([CH:13]=[CH2:14])[n:15]1[n:16](-[c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[c:17]2[n:18][c:19]([S:25][CH3:26])[n:20][cH:21][c:22]2[c:23]1=[O:24].[CH3:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:9])=[O:10])[cH:11]1.[NH2:42][c:43]1[cH:44][cH:45][c:46]([N:51]2[CH2:52][CH2:53][N:54]([CH3:57])[CH2:55][CH2:56]2)[c:47]([CH2:49][OH:50])[cH:48]1.[Na+:58].[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1.[OH:59][C:60](=[O:61])[O-:62]>>[CH2:12]([CH:13]=[CH2:14])[n:15]1[n:16](-[c:27]2[n:28][cH:29][cH:30][cH:31][cH:32]2)[c:17]2[n:18][c:19]([NH:42][c:43]3[cH:44][cH:45][c:46]([N:51]4[CH2:52][CH2:53][N:54]([CH3:57])[CH2:55][CH2:56]4)[c:47]([CH2:49][OH:50])[cH:48]3)[n:20][cH:21][c:22]2[c:23]1=[O:24]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-02bac73ddca44d9cbc242ee788c1ebfb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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