Sodium ion → 3'-chloro-4-(5-methyl-1-phenyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl

HRID 1212443Notes

Reaction equation

HRID 1212443 reaction equation
[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[CH3:14][c:15]1[c:16]([CH:26]=[O:27])[cH:17][n:18][n:19]1-[c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[Cl:1][c:2]1[c:3]([N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[n:4][cH:5][cH:6][n:7]1.[Na+:41].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[Cl:1][c:2]1[c:3]([N:8]2[CH2:9][CH2:10][N:11]([CH2:26][c:16]3[c:15]([CH3:14])[n:19](-[c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[n:18][cH:17]3)[CH2:12][CH2:13]2)[n:4][cH:5][cH:6][n:7]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 2724942TriacetoxyborohydrideHCID 27764375-Methyl-1-phenyl-1H-pyrazole-4-carboxaldehydeHCID 140864382-Chloro-3-(piperazin-1-yl)pyrazine

Product 1

HCID 866416633'-chloro-4-(5-methyl-1-phenyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl

Sources & evidence

ORD record
ord-3c912925750146b18ea88adec5be5fbe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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