Potassium Cation → HCID 178489263, compound

HRID 1240929Notes

Reaction equation

HRID 1240929 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:29])[c:10]3[nH:11][n:12][c:13]([C:24]([CH3:25])([CH3:26])[CH2:27][OH:28])[c:14]3[CH:15]2[c:16]2[c:17]([O:22][CH3:23])[cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1.[CH3:46][O:47][CH2:48][CH2:49][O:50][CH3:51].[K+:43].[K+:44].[K+:45].[OH2:52].[P:38]([O-:39])([O-:40])([O-:41])=[O:42].[s:30]1[cH:31][c:32]([B:35]([OH:36])[OH:37])[cH:33][cH:34]1>>[c:2]1(-[c:32]2[cH:31][s:30][cH:34][cH:33]2)[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:29])[c:10]3[nH:11][n:12][c:13]([C:24]([CH3:25])([CH3:26])[CH2:27][OH:28])[c:14]3[CH:15]2[c:16]2[c:17]([O:22][CH3:23])[cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 80711,2-DimethoxyethaneHCID 581760Thiophene-3-boronic acidHCID 1784892625-(4-bromophenyl)-3-(1-hydroxymethyl-1-methylethyl)-4-(2-methoxyphenyl)-4,5-dihydro-1H-pyrrolo[3,4-c]pyrazole-6-one

Product 1

HCID 178489263HCID 178489263, compound

Sources & evidence

ORD record
ord-cd4b0a2000524d15a23d8ab82c723dde
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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