Water → Purine-2,6(1H,3H)-dione, 7-(2-bromobenzyl)-8-chloro-1,3-dimethyl-

HRID 139593

Reaction equation

HRID 139593 reaction equation
[Br:15][c:16]1[c:17]([CH2:18][Br:19])[cH:20][cH:21][cH:22][cH:23]1.[CH3:1][n:2]1[c:3]2[n:4][c:5]([Cl:6])[nH:7][c:8]2[c:9](=[O:10])[n:11]([CH3:12])[c:13]1=[O:14].[CH3:24][CH2:25][O:26][C:27]([CH3:28])=[O:29].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35].[OH2:30]>>[CH3:1][n:2]1[c:3]2[n:4][c:5]([Cl:6])[n:7]([CH2:18][c:17]3[c:16]([Br:15])[cH:23][cH:22][cH:21][cH:20]3)[c:8]2[c:9](=[O:10])[n:11]([CH3:12])[c:13]1=[O:14]

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 106618-ChlorotheophyllineHCID 769652-Bromobenzyl bromideHCID 81531Diisopropylethylamine

Product 1

HCID 598207Purine-2,6(1H,3H)-dione, 7-(2-bromobenzyl)-8-chloro-1,3-dimethyl-

Sources & evidence

ORD record
ord-17c35232ac754834b5c619e3e094d0be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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