Bicarbonate Ion → 5-[3-(2-methoxy-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-2-(2-oxo-oxazolidin-3-yl)-benzamide

HRID 1560972Notes

Reaction equation

HRID 1560972 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([N:13]2[C:14](=[O:18])[O:15][CH2:16][CH2:17]2)[c:6]([C:7](=[O:8])[N:9]([CH3:10])[CH3:11])[cH:12]1.[C:53](=[O:54])([OH:55])[O-:56].[CH3:19][O:20][c:21]1[c:22](-[c:27]2[n:28][n:29]([CH2:45][O:46][CH2:47][CH2:48][Si:49]([CH3:50])([CH3:51])[CH3:52])[c:30]3[n:31][cH:32][c:33]([B:36]4[O:37][C:38]([CH3:39])([CH3:40])[C:41]([CH3:42])([CH3:43])[O:44]4)[cH:34][c:35]23)[cH:23][cH:24][cH:25][cH:26]1.[Na+:57].[OH2:58]>>[c:2]1(-[c:33]2[cH:32][n:31][c:30]3[n:29]([CH2:45][O:46][CH2:47][CH2:48][Si:49]([CH3:50])([CH3:51])[CH3:52])[n:28][c:27](-[c:22]4[c:21]([O:20][CH3:19])[cH:26][cH:25][cH:24][cH:23]4)[c:35]3[cH:34]2)[cH:3][cH:4][c:5]([N:13]2[C:14](=[O:18])[O:15][CH2:16][CH2:17]2)[c:6]([C:7](=[O:8])[N:9]([CH3:10])[CH3:11])[cH:12]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 579757195-bromo-N,N-dimethyl-2-(2-oxo-oxazolidin-3-yl)-benzamideHCID 598360923-(2-methoxy-phenyl)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1-(2-trimethylsilanyl-ethoxy-methyl)-1H-pyrazolo[3,4-b]pyridine

Product 1

HCID 686629715-[3-(2-methoxy-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]-N,N-dimethyl-2-(2-oxo-oxazolidin-3-yl)-benzamide

Sources & evidence

ORD record
ord-26913731e0ed4d7ebef1edfa94d735da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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