Potassium Cation → HCID 21897421, compound

HRID 2316549Notes

Reaction equation

HRID 2316549 reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][o:6][c:7]([CH2:9][N:10]2[CH2:11][CH:12]([NH2:15])[CH2:13][CH2:14]2)[n:8]1.[Cl:16][c:17]1[c:18]2[c:19]([n:20][cH:21][n:22]1)[n:23](-[c:26]1[c:27]([F:36])[cH:28][c:29]([S:32](=[O:33])(=[O:34])[CH3:35])[cH:30][cH:31]1)[n:24][cH:25]2.[K+:41].[K+:42].[OH2:43]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[n:5][o:6][c:7]([CH2:9][N:10]2[CH2:11][CH:12]([NH:15][c:17]3[c:18]4[c:19]([n:20][cH:21][n:22]3)[n:23](-[c:26]3[c:27]([F:36])[cH:28][c:29]([S:32](=[O:33])(=[O:34])[CH3:35])[cH:30][cH:31]3)[n:24][cH:25]4)[CH2:13][CH2:14]2)[n:8]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 218976614-Chloro-1-(2-fluoro-4-methanesulfonyl-phenyl)-1H-pyrazolo[3,4-d]pyrimidineHCID 574963751-{[3-(Propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}pyrrolidin-3-amine

Product 1

HCID 21897421HCID 21897421, compound

Sources & evidence

ORD record
ord-73f4fcef4a8542fd8ab295e1fcc78222
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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