Acetic Acid → 2-Bromomethyl-4-(3-chloro-phenyl)-6-[4-(3-trifluoromethyl-pyridin-2-yl)-piperazin-1-yl]-pyrimidine

HRID 300850Notes

Reaction equation

HRID 300850 reaction equation
[BrH:33].[C:34]([OH:35])(=[O:36])[CH3:37].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][c:10]([CH2:30][O:31][CH3:32])[n:11][c:12]([N:14]3[CH2:15][CH2:16][N:17]([c:20]4[n:21][cH:22][cH:23][cH:24][c:25]4[C:26]([F:27])([F:28])[F:29])[CH2:18][CH2:19]3)[cH:13]2)[cH:5][cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][c:10]([CH2:30][Br:33])[n:11][c:12]([N:14]3[CH2:15][CH2:16][N:17]([c:20]4[n:21][cH:22][cH:23][cH:24][c:25]4[C:26]([F:27])([F:28])[F:29])[CH2:18][CH2:19]3)[cH:13]2)[cH:5][cH:6][cH:7]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 577611754-(3-Chloro-phenyl)-2-methoxymethyl-6-[4-(3-trifluoromethyl-pyridin-2-yl)-piperazin-1-yl]-pyrimidine

Product 1

HCID 577614002-Bromomethyl-4-(3-chloro-phenyl)-6-[4-(3-trifluoromethyl-pyridin-2-yl)-piperazin-1-yl]-pyrimidine

Sources & evidence

ORD record
ord-ddd1ee5d7fdc467e99b2623c6833fe78
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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