Potassium Cation → HCID 58529330, compound

HRID 2312272Notes

Reaction equation

HRID 2312272 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]2[cH:11][c:12]([B:17]3[O:18][C:19]([CH3:20])([CH3:21])[C:22]([CH3:23])([CH3:24])[O:25]3)[cH:13][cH:14][c:15]2[cH:16]1.[K+:54].[K+:55].[K+:56].[NH2:26][c:27]1[n:28][cH:29][n:30][n:31]2[c:32]1[c:33]([Br:48])[cH:34][c:35]2[CH:36]1[CH2:37][N:38]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:39][CH2:40]1.[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[OH2:57].[P:49]([O-:50])([O-:51])([O-:52])=[O:53]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]2[cH:11][c:12](-[c:33]3[c:32]4[c:27]([NH2:26])[n:28][cH:29][n:30][n:31]4[c:35]([CH:36]4[CH2:37][N:38]([C:41](=[O:42])[O:43][C:44]([CH3:45])([CH3:46])[CH3:47])[CH2:39][CH2:40]4)[cH:34]3)[cH:13][cH:14][c:15]2[cH:16]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 6228DimethylformamideHCID 585293132-benzyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-IndazoleHCID 59231934HCID 59231934, compound

Product 1

HCID 58529330HCID 58529330, compound

Sources & evidence

ORD record
ord-8e8c95371b8343fda025ace382281f0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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