Piperazin-2-one → 4-{2-[(4-{[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}-1H-pyrazolo[3,4-d]pyrimidin-3-yl)oxy]ethyl}piperazin-2-one

HRID 160776Notes

Reaction equation

HRID 160776 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:29])[c:18]([O:21][CH2:22][c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:19][cH:20]3)[c:13]12.[NH:30]1[C:31](=[O:36])[CH2:32][NH:33][CH2:34][CH2:35]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:29])[c:18]([O:21][CH2:22][c:23]4[n:24][cH:25][cH:26][cH:27][cH:28]4)[cH:19][cH:20]3)[c:13]12)[N:33]1[CH2:32][C:31](=[O:36])[NH:30][CH2:35][CH2:34]1

Participants

3

Reactant 2

HCID 231360Piperazin-2-oneHCID 115028913-(2-chloroethoxy)-N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Product 1

HCID 115477634-{2-[(4-{[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}-1H-pyrazolo[3,4-d]pyrimidin-3-yl)oxy]ethyl}piperazin-2-one

Sources & evidence

ORD record
ord-16095c152bc54f788f95e23c010abb58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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