Potassium Cation → 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[5-({[2-(methyloxy)ethyl]amino}methyl)-3-pyridinyl]-1H-indole-7-carboxamide

HRID 193160Notes

Reaction equation

HRID 193160 reaction equation
[Br:22][c:23]1[cH:24][c:25]2[c:26]([CH:35]3[CH2:36][CH2:37][N:38]([S:41](=[O:42])(=[O:43])[CH2:44][CH3:45])[CH2:39][CH2:40]3)[cH:27][nH:28][c:29]2[c:30]([C:32](=[O:33])[NH2:34])[cH:31]1.[C:46](=[O:47])([O-:48])[O-:49].[CH3:1][O:2][CH2:3][CH2:4][NH:5][CH2:6][c:7]1[cH:8][n:9][cH:10][c:11]([B:13]2[O:14][C:15]([CH3:16])([CH3:17])[C:18]([CH3:19])([CH3:20])[O:21]2)[cH:12]1.[K+:50].[K+:51]>>[CH3:1][O:2][CH2:3][CH2:4][NH:5][CH2:6][c:7]1[cH:8][n:9][cH:10][c:11](-[c:23]2[cH:24][c:25]3[c:26]([CH:35]4[CH2:36][CH2:37][N:38]([S:41](=[O:42])(=[O:43])[CH2:44][CH3:45])[CH2:39][CH2:40]4)[cH:27][nH:28][c:29]3[c:30]([C:32](=[O:33])[NH2:34])[cH:31]2)[cH:12]1

Participants

5

Reactant 4

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 113844275-bromo-3-[1-(ethanesulfonyl)-4-piperidinyl]-1H-indole-7-carboxamideHCID 574157115-(((2-Methoxyethyl)amino)methyl)pyridine-3-boronic acid pinacol ester

Product 1

HCID 577328233-[1-(ethylsulfonyl)-4-piperidinyl]-5-[5-({[2-(methyloxy)ethyl]amino}methyl)-3-pyridinyl]-1H-indole-7-carboxamide

Sources & evidence

ORD record
ord-c1216ed8da6943caa18d5acc4890154b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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