Sodium ion → 1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(6-(2-methoxypyrimidin-5-yl)-5-methylpyridin-2-yl)cyclopropanecarboxamide

HRID 688727Notes

Reaction equation

HRID 688727 reaction equation
[C:43](=[O:44])([O-:45])[O-:46].[CH3:1][O:2][c:3]1[n:4][cH:5][c:6]([B:9]([OH:10])[OH:11])[cH:7][n:8]1.[CH3:37][O:38][CH2:39][CH2:40][O:41][CH3:42].[Cl:12][c:13]1[c:14]([CH3:36])[cH:15][cH:16][c:17]([NH:19][C:20](=[O:21])[C:22]2([c:25]3[cH:26][c:27]4[c:28]([cH:34][cH:35]3)[O:29][C:30]([F:32])([F:33])[O:31]4)[CH2:23][CH2:24]2)[n:18]1.[Na+:47].[Na+:48].[cH:49]1[cH:50][cH:51][c:52]([P:53]([Pd:54]([P:55]([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[P:93]([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)([c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[cH:124][cH:125]1>>[CH3:1][O:2][c:3]1[n:4][cH:5][c:6](-[c:13]2[c:14]([CH3:36])[cH:15][cH:16][c:17]([NH:19][C:20](=[O:21])[C:22]3([c:25]4[cH:26][c:27]5[c:28]([cH:34][cH:35]4)[O:29][C:30]([F:32])([F:33])[O:31]5)[CH2:23][CH2:24]3)[n:18]2)[cH:7][n:8]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27367782-Methoxypyrimidine-5-boronic acidHCID 59165796N-(6-chloro-5-methylpyridin-2-yl)-1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclopropane-1-carboxamideHCID 178420554HCID 178420554, compound

Product 1

HCID 591658501-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(6-(2-methoxypyrimidin-5-yl)-5-methylpyridin-2-yl)cyclopropanecarboxamide

Sources & evidence

ORD record
ord-87c51710018c492a816dcdae1a685a6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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