Citric Acid → 4-(3-Chloro-4-methoxybenzylamino)-5-carboxy-2,6-dichloropyrimidine

HRID 2339144Notes

Reaction equation

HRID 2339144 reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[c:5]([Cl:12])[n:6][c:7]([Cl:11])[n:8][c:9]1[Cl:10].[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH3:31][N:32]([CH3:33])[CH:34]=[O:35].[Cl:13][c:14]1[cH:15][c:16]([CH2:17][NH2:18])[cH:19][cH:20][c:21]1[O:22][CH3:23].[OH:36][C:37]([CH2:38][C:39]([C:40](=[O:41])[OH:42])([CH2:43][C:44](=[O:45])[OH:46])[OH:47])=[O:48]>>[C:1](=[O:2])([OH:3])[c:4]1[c:5]([Cl:12])[n:6][c:7]([Cl:11])[n:8][c:9]1[NH:18][CH2:17][c:16]1[cH:15][c:14]([Cl:13])[c:21]([O:22][CH3:23])[cH:20][cH:19]1

Participants

6

Reactant 5

HCID 311Citric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 7380383-Chloro-4-methoxybenzylamineHCID 200839572,4,6-Trichloropyrimidine-5-carboxylic acid

Product 1

HCID 178482874-(3-Chloro-4-methoxybenzylamino)-5-carboxy-2,6-dichloropyrimidine

Sources & evidence

ORD record
ord-6d759c4ec1f24d1497c83589e8fd183e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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