Acetate → tert-butyl 2-{[4-amino-2-ethoxymethyl-7-(pyridin-3-yl)-1H-imidazo[4,5-c]quinolin-1-yl]methyl}piperidine-1-carboxylate

HRID 1113228Notes

Reaction equation

HRID 1113228 reaction equation
[CH2:34]([OH:35])[CH2:36][CH2:37][OH:38].[NH2:1][c:2]1[n:3][c:4]2[cH:5][c:6]([Br:33])[cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:29][O:30][CH2:31][CH3:32])[n:14]2[CH2:15][CH:16]1[N:17]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH2:18][CH2:19][CH2:20][CH2:21]1.[O-:49][C:50]([CH3:51])=[O:52].[O-:53][C:54]([CH3:55])=[O:56].[Pd+2:48].[n:39]1[cH:40][c:41]([B:45]([OH:46])[OH:47])[cH:42][cH:43][cH:44]1>>[NH2:1][c:2]1[n:3][c:4]2[cH:5][c:6](-[c:41]3[cH:40][n:39][cH:44][cH:43][cH:42]3)[cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:29][O:30][CH2:31][CH3:32])[n:14]2[CH2:15][CH:16]1[N:17]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH2:18][CH2:19][CH2:20][CH2:21]1

Participants

6

Reactant 5

HCID 175Acetate2×HCID 104421,3-PropanediolHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343783-Pyridinylboronic acidHCID 21984199tert-Butyl 2-[(4-amino-7-bromo-2-ethoxymethyl-1H-imidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylate

Product 1

HCID 21984345tert-butyl 2-{[4-amino-2-ethoxymethyl-7-(pyridin-3-yl)-1H-imidazo[4,5-c]quinolin-1-yl]methyl}piperidine-1-carboxylate

Sources & evidence

ORD record
ord-f1d2b6b49f10459ead6d5b409d61d55c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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