Hydrochloric Acid → 1-[2-(4-aminopiperidin-1-yl)ethyl]-5,7-difluoroquinoxalin-2(1H)-one

HRID 676815Notes

Reaction equation

HRID 676815 reaction equation
[C:1]([N:5]([C:2](=[O:3])[O-:4])[CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][n:17]2[c:18](=[O:29])[cH:19][n:20][c:21]3[c:22]([F:28])[cH:23][c:24]([F:27])[cH:25][c:26]23)[CH2:13][CH2:14]1)([CH3:6])([CH3:7])[CH3:8].[C:38](=[O:39])([O-:40])[O-:41].[CH:51]([Cl:52])([Cl:53])[Cl:54].[ClH:30].[ClH:31].[Na+:42].[Na+:43].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49]1.[OH2:50]>>[NH2:5][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][n:17]2[c:18](=[O:29])[cH:19][n:20][c:21]3[c:22]([F:28])[cH:23][c:24]([F:27])[cH:25][c:26]23)[CH2:13][CH2:14]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 923Sodium ion2×HCID 962WaterHCID 6212ChloroformHCID 19660Carbonate IonHCID 312751,4-Dioxane2×HCID 178449658HCID 178449658, compound

Product 1

HCID 667741441-[2-(4-aminopiperidin-1-yl)ethyl]-5,7-difluoroquinoxalin-2(1H)-one

Sources & evidence

ORD record
ord-d619adb3fa1a4238b07f8f5e2c4c1d69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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