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Hydrochloric Acid → N4-{3-Fluoro-4-[(1-methyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]phenyl}-6-pyridin-4-ylpyrimidine-2,4-diamine

HRID 91235
Notes
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Reaction equation

HRID 91235 reaction equation
[Cl:20][c:21]1[n:22][c:23]([NH2:33])[n:24][c:25](-[c:27]2[cH:28][cH:29][n:30][cH:31][cH:32]2)[cH:26]1.[ClH:34].[F:1][c:2]1[c:3]([NH:9][c:10]2[c:11]3[c:12]([n:13][cH:14][cH:15]2)[n:16]([CH3:19])[cH:17][cH:18]3)[cH:4][cH:5][c:6]([NH2:8])[cH:7]1.[Na+:36].[OH-:35].[OH2:37]>>[F:1][c:2]1[c:3]([NH:9][c:10]2[c:11]3[c:12]([n:13][cH:14][cH:15]2)[n:16]([CH3:19])[cH:17][cH:18]3)[cH:4][cH:5][c:6]([NH:8][c:21]2[n:22][c:23]([NH2:33])[n:24][c:25](-[c:27]3[cH:28][cH:29][n:30][cH:31][cH:32]3)[cH:26]2)[cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 223242864-Chloro-6-(pyridin-4-yl)pyrimidin-2-amineHCID 593050222-Fluoro-N1-(1-methyl-1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,4-diamine

Product 1

HCID 11510153
N4-{3-Fluoro-4-[(1-methyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]phenyl}-6-pyridin-4-ylpyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-150d764b0a7545efab781880ed70a83e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes