Potassium Cation → HCID 77444099, compound

HRID 91961Notes

Reaction equation

HRID 91961 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH3:25])[c:5](-[n:8]2[c:9](=[O:24])[nH:10][n:11][c:12]2[CH2:13][CH:14]2[CH2:15][N:16]([C:19](=[O:20])[CH:21]3[CH2:22][CH2:23]3)[CH2:17][CH2:18]2)[cH:6][cH:7]1.[CH2:42]1[O:43][CH2:44][CH2:45][O:46][CH2:47]1.[K+:36].[K+:37].[O-:38][C:39]([O-:40])=[O:41].[OH2:48].[OH:26][B:27]([OH:28])[c:29]1[cH:30][cH:31][c:32]([F:33])[cH:34][cH:35]1>>[c:2]1(-[c:29]2[cH:30][cH:31][c:32]([F:33])[cH:34][cH:35]2)[cH:3][c:4]([CH3:25])[c:5](-[n:8]2[c:9](=[O:24])[nH:10][n:11][c:12]2[CH2:13][CH:14]2[CH2:15][N:16]([C:19](=[O:20])[CH:21]3[CH2:22][CH2:23]3)[CH2:17][CH2:18]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 2856454-Fluorophenylboronic acidHCID 1784224334-(4-bromo-2-methylphenyl)-3-[[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]methyl]-1H-1,2,4-triazol-5-one

Product 1

HCID 77444099HCID 77444099, compound

Sources & evidence

ORD record
ord-f1261343f3364b6fb5de661474d016f9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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