Sodium ion → N6-methyl-2-morpholino-N6-(tetrahydro-2H-pyran-4-yl)-4,5'-bipyrimidine-2',6-diamine

HRID 680730Notes

Reaction equation

HRID 680730 reaction equation
[C:38](=[O:39])([O-:40])[O-:41].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[cH:10][n:11][c:12]([NH2:15])[n:13][cH:14]2)[O:16]1.[Cl:17][c:18]1[cH:19][c:20]([N:30]([CH:31]2[CH2:32][CH2:33][O:34][CH2:35][CH2:36]2)[CH3:37])[n:21][c:22]([N:24]2[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2)[n:23]1.[Na+:42].[Na+:43]>>[c:9]1(-[c:18]2[cH:19][c:20]([N:30]([CH:31]3[CH2:32][CH2:33][O:34][CH2:35][CH2:36]3)[CH3:37])[n:21][c:22]([N:24]3[CH2:25][CH2:26][O:27][CH2:28][CH2:29]3)[n:23]2)[cH:10][n:11][c:12]([NH2:15])[n:13][cH:14]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 177502122-Aminopyrimidine-5-boronic acid, pinacol esterHCID 595076066-chloro-N-methyl-2-morpholino-N-(tetrahydro-2H-pyran-4-yl)pyrimidin-4-amine

Product 1

HCID 59507568N6-methyl-2-morpholino-N6-(tetrahydro-2H-pyran-4-yl)-4,5'-bipyrimidine-2',6-diamine

Sources & evidence

ORD record
ord-5012b6d2847948d6bacd952c87aba48c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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