Trifluoroacetic acid → 4-[2-(4-Aminopiperidin-1-yl)ethyl]-6-chloro-1,2,4-benzotriazin-3(4H)-one

HRID 831556Notes

Reaction equation

HRID 831556 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:28])[n:19][n:20][c:21]3[c:22]2[cH:23][c:24]([Cl:27])[cH:25][cH:26]3)[CH2:13][CH2:14]1)([CH3:6])([CH3:7])[CH3:8].[F:29][C:30]([F:31])([F:32])[C:33]([OH:34])=[O:35].[NH2:36][CH:37]1[CH2:38][CH2:39][N:40]([CH2:41][CH2:42][n:43]2[c:44]3[c:45]([cH:46][c:47]([C:48]#[N:49])[cH:50][cH:51]3)[n:52][cH:53][c:54]2=[O:55])[CH2:56][CH2:57]1>>[NH2:5][CH:9]1[CH2:10][CH2:11][N:12]([CH2:15][CH2:16][n:17]2[c:18](=[O:28])[n:19][n:20][c:21]3[c:22]2[cH:23][c:24]([Cl:27])[cH:25][cH:26]3)[CH2:13][CH2:14]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 667741351-[2-(4-Aminopiperidin-1-yl)ethyl]-2-oxo-1,2-dihydroquinoxaline-6-carbonitrileHCID 178449668N-tert-butyl-N-[1-[2-(6-chloro-3-oxo-1,2,4-benzotriazin-4-yl)ethyl]piperidin-4-yl]carbamate

Product 1

HCID 667742944-[2-(4-Aminopiperidin-1-yl)ethyl]-6-chloro-1,2,4-benzotriazin-3(4H)-one

Sources & evidence

ORD record
ord-c2776deae34a4afbaec2eaee8a93fcdf
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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