Sodium ion → 3-(2-(4-(1-amino-2-methylpropan-2-yl)phenyl)acetyl)quinolin-4(1H)-one

HRID 1213823Notes

Reaction equation

HRID 1213823 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][C:9]([CH3:10])([c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18]([c:19]2[cH:20][nH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]3[c:28]2=[O:29])=[O:30])[cH:15][cH:16]1)[CH3:31])([CH3:5])([CH3:6])[CH3:32].[Cl:42][CH2:43][Cl:44].[F:33][C:34]([F:35])([F:36])[C:37]([OH:38])=[O:39].[Na+:41].[OH-:40]>>[NH2:7][CH2:8][C:9]([CH3:10])([c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18]([c:19]2[cH:20][nH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]3[c:28]2=[O:29])=[O:30])[cH:15][cH:16]1)[CH3:31]

Participants

6

Reactant 5

HCID 923Sodium ionHCID 961HydroxideHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 66675698(2-Methyl-2-{4-[2-oxo-2-(4-oxo-1,4-dihydro-quinolin-3-yl)-ethyl]-phenyl}-propyl)-carbamic acid tert-butyl ester

Product 1

HCID 666753983-(2-(4-(1-amino-2-methylpropan-2-yl)phenyl)acetyl)quinolin-4(1H)-one

Sources & evidence

ORD record
ord-00ffe27f58074db0b8249841ce038e85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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