Potassium Cation → 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[4-(4-methyl-2-oxo-1-piperazinyl)phenyl]-1H-indole-7-carboxamide

HRID 91440Notes

Reaction equation

HRID 91440 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([CH:14]3[CH2:15][CH2:16][N:17]([S:20](=[O:21])(=[O:22])[CH2:23][CH3:24])[CH2:18][CH2:19]3)[cH:6][nH:7][c:8]2[c:9]([C:11](=[O:12])[NH2:13])[cH:10]1.[C:48](=[O:49])([O-:50])[O-:51].[CH3:25][N:26]1[CH2:27][C:28](=[O:47])[N:29]([c:32]2[cH:33][cH:34][c:35]([B:38]3[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]3)[cH:36][cH:37]2)[CH2:30][CH2:31]1.[K+:52].[K+:53].[O:54]1[CH2:55][CH2:56][O:57][CH2:58][CH2:59]1.[OH2:60]>>[c:2]1(-[c:35]2[cH:34][cH:33][c:32]([N:29]3[C:28](=[O:47])[CH2:27][N:26]([CH3:25])[CH2:31][CH2:30]3)[cH:37][cH:36]2)[cH:3][c:4]2[c:5]([CH:14]3[CH2:15][CH2:16][N:17]([S:20](=[O:21])(=[O:22])[CH2:23][CH3:24])[CH2:18][CH2:19]3)[cH:6][nH:7][c:8]2[c:9]([C:11](=[O:12])[NH2:13])[cH:10]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 113844275-bromo-3-[1-(ethanesulfonyl)-4-piperidinyl]-1H-indole-7-carboxamideHCID 667228024-Methyl-1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-2-one

Product 1

HCID 577326733-[1-(ethylsulfonyl)-4-piperidinyl]-5-[4-(4-methyl-2-oxo-1-piperazinyl)phenyl]-1H-indole-7-carboxamide

Sources & evidence

ORD record
ord-c0f9dc6acf8a401d85482696ed8a84af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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