Hydrochloric Acid → N-{4-[4-(8-Oxa-3-aza-bicyclo[3.2.1]oct-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-phenyl}-acetamide

HRID 299348Notes

Reaction equation

HRID 299348 reaction equation
[CH:1]12[CH2:2][N:3]([c:9]3[c:10]4[c:11]([n:12][c:13](-[c:15]5[cH:16][cH:17][c:18]([NH:21][C:22]([CH3:23])=[O:24])[cH:19][cH:20]5)[n:14]3)[n:25]([CH:28]3[CH2:29][CH2:30][CH2:31][CH2:32][O:33]3)[n:26][cH:27]4)[CH2:4][CH:5]([CH2:6][CH2:7]1)[O:8]2.[ClH:34].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[CH:1]12[CH2:2][N:3]([c:9]3[c:10]4[c:11]([n:12][c:13](-[c:15]5[cH:16][cH:17][c:18]([NH:21][C:22]([CH3:23])=[O:24])[cH:19][cH:20]5)[n:14]3)[nH:25][n:26][cH:27]4)[CH2:4][CH:5]([CH2:6][CH2:7]1)[O:8]2

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 66589148N-{4-[4-(8-Oxa-3-aza-bicyclo[3.2.1]oct-3-yl)-1-(tetrahydro-pyran-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-phenyl}-acetamide

Product 1

HCID 57654282N-{4-[4-(8-Oxa-3-aza-bicyclo[3.2.1]oct-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]-phenyl}-acetamide

Sources & evidence

ORD record
ord-338a68fe7fba4ebbbd73b18bcd3352cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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