Potassium Cation → HCID 66777613, compound

HRID 1122130Notes

Reaction equation

HRID 1122130 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:35])[c:8]([CH:10]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[NH:17][c:18]3[cH:19][cH:20][c:21]([C:24](=[O:25])[N:26]([CH2:27][CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH3:34])[cH:22][cH:23]3)[o:9]2)[cH:36]1.[C:52](=[O:53])([O-:54])[O-:55].[CH3:37][n:38]1[n:39][cH:40][c:41]([B:43]2[O:44][C:45]([CH3:46])([CH3:47])[C:48]([CH3:49])([CH3:50])[O:51]2)[cH:42]1.[CH3:58][N:59]([CH3:60])[C:61](=[O:62])[CH3:63].[K+:56].[K+:57]>>[c:2]1(-[c:41]2[cH:40][n:39][n:38]([CH3:37])[cH:42]2)[cH:3][cH:4][c:5]2[c:6]([c:7]([CH3:35])[c:8]([CH:10]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[NH:17][c:18]3[cH:19][cH:20][c:21]([C:24](=[O:25])[N:26]([CH2:27][CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH3:34])[cH:22][cH:23]3)[o:9]2)[cH:36]1

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 27739871-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazoleHCID 66778109Ethyl 3-{[(4-{[(5-bromo-3-methyl-1-benzofuran-2-yl)(cyclohexyl)methyl]amino}phenyl)carbonyl](methyl)amino}-propanoate

Product 1

HCID 66777613HCID 66777613, compound

Sources & evidence

ORD record
ord-618747c3ecd64ee28c724805b2f0c611
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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