Hydrogen Bromide → 5-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-pyrimidine-2,4-diamine

HRID 689816

Reaction equation

HRID 689816 reaction equation
[Br:23][CH2:24][c:25]1[c:26]([NH2:32])[n:27][c:28]([NH2:31])[n:29][cH:30]1.[BrH:21].[BrH:22].[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH3:33][N:34]([CH3:35])[CH:36]=[O:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([CH2:24][c:25]3[c:26]([NH2:32])[n:27][c:28]([NH2:31])[n:29][cH:30]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 260Hydrogen Bromide2×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 974781-(4-Chlorophenyl)piperazineHCID 4273182,4-Diamino-5-(bromomethyl)pyrimidine

Product 1

HCID 214736515-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-c932ef8af7f04d018e2a3f889dc47f95
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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