Hydrochloric Acid → 2-[4-Amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methylpropionamide

HRID 1209033Notes

Reaction equation

HRID 1209033 reaction equation
[Br:26][C:27]([C:28](=[O:29])[NH2:30])([CH3:31])[CH3:32].[CH3:34][N:35]1[CH2:36][CH2:37][CH2:38][N:39]([CH3:40])[C:41]1=[O:42].[ClH:33].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[nH:8][cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:15][cH:16]1.[Na+:25].[OH-:24].[OH2:43]>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([C:27]([C:28](=[O:29])[NH2:30])([CH3:31])[CH3:32])[cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:15][cH:16]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 1012352-Bromo-2-methylpropanamideHCID 120422345-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine

Product 1

HCID 227362342-[4-Amino-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-2-methylpropionamide

Sources & evidence

ORD record
ord-98148714870c453aaaa5f434bb05a60d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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