Potassium Cation → HCID 178437257, compound

HRID 289508Notes

Reaction equation

HRID 289508 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[n:8]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[cH:9][c:10]2[CH:11]([CH3:12])[c:13]1[c:14]([Cl:21])[c:15]([F:20])[cH:16][cH:17][c:18]1[OH:19].[C:29](=[O:30])([O-:31])[O-:32].[CH3:35][c:36]1[cH:37][cH:38][c:39]([S:40]([O:41][CH2:46][CH:47]2[O:48][C:49]([CH3:52])([CH3:53])[O:50][CH2:51]2)(=[O:42])=[O:43])[cH:44][cH:45]1.[CH3:54][CH2:55][O:56][C:57]([CH3:58])=[O:59].[CH3:65][OH:66].[K+:33].[K+:34].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64]>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[n:8]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[cH:9][c:10]2[CH:11]([CH3:12])[c:13]1[c:14]([Cl:21])[c:15]([F:20])[cH:16][cH:17][c:18]1[O:19][CH2:46][CH:47]1[O:48][C:49]([CH3:52])([CH3:53])[O:50][CH2:51]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 887MethanolHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 2350972,2-Dimethyl-1,3-dioxolan-4-ylmethyl p-toluenesulfonateHCID 670048995-Bromo-3-[1-(2-chloro-3-fluoro-6-hydroxyphenyl)ethyl]pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester

Product 1

HCID 178437257HCID 178437257, compound

Sources & evidence

ORD record
ord-94b1438805ea42d3a10896c4fb6e9c07
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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