Sodium ion → 5-[5-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-pyridin-2-ol

HRID 702620Notes

Reaction equation

HRID 702620 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([OH:17])[n:15][cH:16]1.[CH3:18][O:19][c:20]1[cH:21][c:22]([B:28]([OH:29])[OH:30])[cH:23][cH:24][c:25]1[O:26][CH3:27].[CH3:31][C:32]#[N:33].[Cl:41][Pd-2:42]([Cl:43])([PH:44]([c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)([c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1)[c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)[PH:63]([c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)([c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1.[Na+:34].[Na+:35].[O-:36][C:37](=[O:38])[O-:39].[OH2:40]>>[c:2]1(-[c:22]2[cH:21][c:20]([O:19][CH3:18])[c:25]([O:26][CH3:27])[cH:24][cH:23]2)[cH:3][c:4]2[c:5]([n:6][cH:7]1)[nH:8][cH:9][c:10]2-[c:11]1[cH:12][cH:13][c:14]([OH:17])[n:15][cH:16]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 6342AcetonitrileHCID 19660Carbonate IonHCID 27347023,4-Dimethoxyphenylboronic acidHCID 178418903HCID 178418903, compoundHCID 178515884HCID 178515884, compound

Product 1

HCID 1784887425-[5-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-pyridin-2-ol

Sources & evidence

ORD record
ord-5d3613c52fe244e4be20278408fa69d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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