Acetate → 4-(6-Methoxy-pyridin-3-yl)-2-morpholin-4-yl-7-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine

HRID 187028Notes

Reaction equation

HRID 187028 reaction equation
[C:48]([O-:49])(=[O:50])[CH3:51].[C:53]([O-:54])(=[O:55])[CH3:56].[CH3:23][O:24][c:25]1[n:26][cH:27][c:28]([B:31]2[O:32][C:33]([CH3:34])([CH3:35])[C:36]([CH3:37])([CH3:38])[O:39]2)[cH:29][cH:30]1.[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[Cl:1][c:2]1[c:3]2[c:4]([n:5][c:6]([N:8]3[CH2:9][CH2:10][O:11][CH2:12][CH2:13]3)[n:7]1)[N:14]([c:17]1[cH:18][n:19][cH:20][cH:21][cH:22]1)[CH2:15][CH2:16]2.[K+:45].[K+:46].[K+:47].[P:40]([O-:41])([O-:42])([O-:43])=[O:44].[Pd+2:52]>>[c:2]1(-[c:28]2[cH:27][n:26][c:25]([O:24][CH3:23])[cH:30][cH:29]2)[c:3]2[c:4]([n:5][c:6]([N:8]3[CH2:9][CH2:10][O:11][CH2:12][CH2:13]3)[n:7]1)[N:14]([c:17]1[cH:18][n:19][cH:20][cH:21][cH:22]1)[CH2:15][CH2:16]2

Participants

8

Reactant 7

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 1061PhosphateHCID 6228DimethylformamideHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 162177142-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridineHCID 592450134-Chloro-2-morpholin-4-yl-7-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine

Product 1

HCID 248900984-(6-Methoxy-pyridin-3-yl)-2-morpholin-4-yl-7-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine

Sources & evidence

ORD record
ord-210dfbbdce7b4b438bd7b0f7eccc8153
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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