Sodium ion → 6-pyrrolidin-1-yl-4H-isoquinoline-1,3-dione

HRID 100109Notes

Reaction equation

HRID 100109 reaction equation
[BH4-:23].[CH3:14][O:15][CH:16]1[CH2:20][CH2:19][CH:18]([O:17][CH3:21])[O:22]1.[NH2:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[C:8](=[O:12])[NH:7][C:6](=[O:13])[CH2:5]2.[Na+:24].[OH:25][C:26]([C:27]([F:28])([F:29])[F:30])=[O:31]>>[N:1]1([c:2]2[cH:3][c:4]3[c:9]([cH:10][cH:11]2)[C:8](=[O:12])[NH:7][C:6](=[O:13])[CH2:5]3)[CH2:16][CH2:20][CH2:19][CH2:18]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 6422Trifluoroacetic acidHCID 28123BorohydrideHCID 790982,5-DimethoxytetrahydrofuranHCID 116224226-Aminoisoquinoline-1,3(2H,4H)-dione

Product 1

HCID 686954026-pyrrolidin-1-yl-4H-isoquinoline-1,3-dione

Sources & evidence

ORD record
ord-2c8bca351e024ae3bf55d7c6376a2d8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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