Acetate → (6-Chloro-4-pyridin-3-yl-quinolin-2-yl)-(2-methoxy-benzyl)-amine

HRID 145066Notes

Reaction equation

HRID 145066 reaction equation
[Br:1][c:2]1[cH:3][c:4]([NH:13][CH2:14][c:15]2[c:16]([O:21][CH3:22])[cH:17][cH:18][cH:19][cH:20]2)[n:5][c:6]2[cH:7][cH:8][c:9]([Cl:12])[cH:10][c:11]12.[C:63]([O-:64])(=[O:65])[CH3:66].[C:68]([O-:69])(=[O:70])[CH3:71].[CH2:51]([CH2:52][O:53][CH3:54])[O:55][CH3:56].[Na+:57].[Na+:58].[O-:59][C:60](=[O:61])[O-:62].[Pd+2:67].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1.[n:23]1[cH:24][c:25]([B:29]([OH:30])[OH:31])[cH:26][cH:27][cH:28]1>>[c:2]1(-[c:25]2[cH:24][n:23][cH:28][cH:27][cH:26]2)[cH:3][c:4]([NH:13][CH2:14][c:15]2[c:16]([O:21][CH3:22])[cH:17][cH:18][cH:19][cH:20]2)[n:5][c:6]2[cH:7][cH:8][c:9]([Cl:12])[cH:10][c:11]12

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343783-Pyridinylboronic acidHCID 68574963(4-Bromo-6-chloro-quinolin-2-yl)-(2-methoxy-benzyl)-amine

Product 1

HCID 68574847(6-Chloro-4-pyridin-3-yl-quinolin-2-yl)-(2-methoxy-benzyl)-amine

Sources & evidence

ORD record
ord-4bc48e831c38403389748f70dae9fbc0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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