Piperidin-4-ol → 1-(2-{[4-({3-chloro-4-[(3-fluorobenzyl)oxy]phenyl}amino)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy}ethyl)piperidin-4-ol

HRID 1127649Notes

Reaction equation

HRID 1127649 reaction equation
[Cl:1][CH2:2][CH2:3][O:4][c:5]1[n:6][nH:7][c:8]2[n:9][cH:10][n:11][c:12]([NH:14][c:15]3[cH:16][c:17]([Cl:30])[c:18]([O:21][CH2:22][c:23]4[cH:24][c:25]([F:29])[cH:26][cH:27][cH:28]4)[cH:19][cH:20]3)[c:13]12.[OH:31][CH:32]1[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1>>[CH2:2]([CH2:3][O:4][c:5]1[n:6][nH:7][c:8]2[n:9][cH:10][n:11][c:12]([NH:14][c:15]3[cH:16][c:17]([Cl:30])[c:18]([O:21][CH2:22][c:23]4[cH:24][c:25]([F:29])[cH:26][cH:27][cH:28]4)[cH:19][cH:20]3)[c:13]12)[N:35]1[CH2:34][CH2:33][CH:32]([OH:31])[CH2:37][CH2:36]1

Participants

3

Reactant 2

HCID 79341Piperidin-4-olHCID 117050313-(2-chloroethoxy)-N-{3-chloro-4-[(3-fluorobenzyl)oxy]phenyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Product 1

HCID 116204871-(2-{[4-({3-chloro-4-[(3-fluorobenzyl)oxy]phenyl}amino)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy}ethyl)piperidin-4-ol

Sources & evidence

ORD record
ord-695df3b5c5444deba48dbda51055269c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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