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Ammonium → Cis-3-{4-[4-(aminomethyl)phenoxy]phenyl}1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

HRID 950950
Notes
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Reaction equation

HRID 950950 reaction equation
[CH3:39][OH:40].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:26]1[CH2:27][CH2:28][CH:29]([N:32]3[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]3)[CH2:30][CH2:31]1)[n:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:15][c:16]2[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]2)[cH:24][cH:25]1.[NH4+:41].[OH-:42].[OH2:43]>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:26]1[CH2:27][CH2:28][CH:29]([N:32]3[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]3)[CH2:30][CH2:31]1)[n:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:15][c:16]2[cH:17][cH:18][c:19]([CH2:20][NH2:21])[cH:22][cH:23]2)[cH:24][cH:25]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 223AmmoniumHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 20817052cis-4-(4-{4-amino-1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenoxy)benzonitrile

Product 1

HCID 20817030
Cis-3-{4-[4-(aminomethyl)phenoxy]phenyl}1-[4-(4-methylpiperazino)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Sources & evidence

ORD record
ord-49a7cca8231a4e7dae217ad6346718f4
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes