Potassium Cation → 4-[4-(4-Methanesulfinyl-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid tert-butyl ester

HRID 2145493

Reaction equation

HRID 2145493 reaction equation
[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[N:18]1[CH2:19][CH2:20][CH:21]([n:24]2[n:25][cH:26][c:27]3[c:28]2[n:29][cH:30][n:31][c:32]3[Cl:33])[CH2:22][CH2:23]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:1][S:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([OH:10])[cH:8][cH:9]1.[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[K+:38].[K+:39].[Na+:40].[Na+:41].[O-:42][C:43](=[O:44])[O-:45]>>[CH3:1][S:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([O:10][c:32]2[c:27]3[cH:26][n:25][n:24]([CH:21]4[CH2:20][CH2:19][N:18]([C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:17])[CH2:23][CH2:22]4)[c:28]3[n:29][cH:30][n:31]2)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 923Sodium ion2×HCID 6228DimethylformamideHCID 19660Carbonate Ion2×HCID 1519364-(Methylsulfinyl)phenolHCID 57964905Tert-butyl 4-(4-chloro-1H-pyrazolo[3,4-D]pyrimidin-1-YL)piperidine-1-carboxylate

Product 1

HCID 579650044-[4-(4-Methanesulfinyl-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-b585e04e02164a3388d3e05080c7ac93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Linked notes

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