Sodium ion → Methyl 3-(6-(1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclo-propanecarboxamido)-3-methylpyridin-2-yl)-5-hydroxybenzoate

HRID 1573741Notes

Reaction equation

HRID 1573741 reaction equation
[CH3:52][O:53][CH2:54][CH2:55][O:56][CH3:57].[Cl:1][c:2]1[c:3]([CH3:25])[cH:4][cH:5][c:6]([NH:8][C:9](=[O:10])[C:11]2([c:14]3[cH:15][c:16]4[c:17]([cH:23][cH:24]3)[O:18][C:19]([F:21])([F:22])[O:20]4)[CH2:12][CH2:13]2)[n:7]1.[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[OH:26][c:27]1[cH:28][c:29]([C:30](=[O:31])[O:32][CH3:33])[cH:34][c:35]([B:37]2[O:38][C:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[O:45]2)[cH:36]1>>[c:2]1(-[c:35]2[cH:34][c:29]([C:30](=[O:31])[O:32][CH3:33])[cH:28][c:27]([OH:26])[cH:36]2)[c:3]([CH3:25])[cH:4][cH:5][c:6]([NH:8][C:9](=[O:10])[C:11]2([c:14]3[cH:15][c:16]4[c:17]([cH:23][cH:24]3)[O:18][C:19]([F:21])([F:22])[O:20]4)[CH2:12][CH2:13]2)[n:7]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 467396923-Hydroxy-5-(methoxycarbonyl)phenylboronic acid, pinacol esterHCID 59165796N-(6-chloro-5-methylpyridin-2-yl)-1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclopropane-1-carboxamide

Product 1

HCID 59166073Methyl 3-(6-(1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclo-propanecarboxamido)-3-methylpyridin-2-yl)-5-hydroxybenzoate

Sources & evidence

ORD record
ord-753bb153a08e4ce4b5ad69b432c59b15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…