1-(3-Methylbutyl)-1H-pyrazole-4-boronic acid → 1-(2-Chloro-3,6-difluorobenzyl)-7-[1-(3-methylbutyl)-1H-pyrazol-4-yl]-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine

HRID 126589Notes

Reaction equation

HRID 126589 reaction equation
[CH3:22][CH:23]([CH2:24][CH2:25][n:26]1[n:27][cH:28][c:29]([B:31]([OH:32])[OH:33])[cH:30]1)[CH3:34].[Cl:1][c:2]1[c:3]([CH2:4][N:5]2[c:6]3[c:7]([n:11][cH:12][c:13]([I:15])[cH:14]3)[NH:8][CH2:9][CH2:10]2)[c:16]([F:21])[cH:17][cH:18][c:19]1[F:20]>>[Cl:1][c:2]1[c:3]([CH2:4][N:5]2[c:6]3[c:7]([n:11][cH:12][c:13](-[c:29]4[cH:28][n:27][n:26]([CH2:25][CH2:24][CH:23]([CH3:22])[CH3:34])[cH:30]4)[cH:14]3)[NH:8][CH2:9][CH2:10]2)[c:16]([F:21])[cH:17][cH:18][c:19]1[F:20]

Participants

3

Reactant 2

HCID 114239411-(3-Methylbutyl)-1H-pyrazole-4-boronic acidHCID 578858681-(2-Chloro-3,6-difluorobenzyl)-7-iodo-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine

Product 1

HCID 578858971-(2-Chloro-3,6-difluorobenzyl)-7-[1-(3-methylbutyl)-1H-pyrazol-4-yl]-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine

Sources & evidence

ORD record
ord-aca5539cde0445da8e5ae0a7a878b944
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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