Sodium ion → N5-[5-(4-methoxy-phenyl)-pyrimidin-2-yl]-2-methyl-pyridine-3,5-diamine

HRID 297537Notes

Reaction equation

HRID 297537 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][c:8]1[c:9]([CH3:29])[n:10][cH:11][c:12]([NH:14][c:15]2[n:16][cH:17][c:18](-[c:21]3[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]3)[cH:19][n:20]2)[cH:13]1)([CH3:5])([CH3:6])[CH3:30].[C:38](=[O:39])([O-:40])[O-:41].[Cl:44][CH2:45][Cl:46].[F:31][C:32]([F:33])([F:34])[C:35]([OH:36])=[O:37].[Na+:42].[Na+:43].[OH2:47]>>[NH2:7][c:8]1[c:9]([CH3:29])[n:10][cH:11][c:12]([NH:14][c:15]2[n:16][cH:17][c:18](-[c:21]3[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]3)[cH:19][n:20]2)[cH:13]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 19660Carbonate IonHCID 67365563HCID 67365563, compound

Product 1

HCID 58171954N5-[5-(4-methoxy-phenyl)-pyrimidin-2-yl]-2-methyl-pyridine-3,5-diamine

Sources & evidence

ORD record
ord-b9e4e1905542409cbd6ea15c7f1fe329
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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