Sodium ion → tert-butyl{1-[2-(7-fluoro-2-oxoquinoxalin-1(2H)-yl)ethyl]piperidin-4-yl}carbamate

HRID 139528

Reaction equation

HRID 139528 reaction equation
[CH3:27][S:28]([O:29][CH2:32][CH2:33][N:34]1[CH2:35][CH2:36][CH:37]([NH:40][C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:38][CH2:39]1)(=[O:30])=[O:31].[CH3:54][CH2:55][O:56][CH2:57][CH3:58].[F:13][c:14]1[cH:15][c:16]2[c:17]([cH:18][cH:19]1)[nH:20][c:21](=[O:22])[cH:23][n:24]2.[F:1][c:2]1[cH:3][cH:4][c:5]2[n:6][cH:7][c:8](=[O:12])[nH:9][c:10]2[cH:11]1.[H-:25].[Na+:26].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:53]>>[F:1][c:2]1[cH:3][cH:4][c:5]2[n:6][cH:7][c:8](=[O:12])[n:9]([CH2:32][CH2:33][N:34]3[CH2:35][CH2:36][CH:37]([NH:40][C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:38][CH2:39]3)[c:10]2[cH:11]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 962WaterHCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 166653HydrideHCID 126863866-Fluoro-1,2-dihydroquinoxalin-2-oneHCID 217275347-fluoroquinoxalin-2(1H)-oneHCID 568344782-(4-((Tert-butoxycarbonyl)amino)piperidin-1-yl)ethyl methanesulfonate

Product 1

HCID 59397942tert-butyl{1-[2-(7-fluoro-2-oxoquinoxalin-1(2H)-yl)ethyl]piperidin-4-yl}carbamate

Sources & evidence

ORD record
ord-78c6a74303fc4ca2bad243269e67dabd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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