Potassium Cation → 7-(1-Methyl-pyrrolidin-3-ylmethoxy)-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-quinoline

HRID 291120Notes

Reaction equation

HRID 291120 reaction equation
[Al+3:2].[C:53]([CH:54]([CH:55]([C:56]([O-:57])=[O:58])[OH:59])[OH:60])([O-:61])=[O:62].[CH2:7]([O:8][C:15](=[O:9])[N:17]1[CH2:18][CH:19]([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27]3[c:28](-[c:34]4[c:35]5[n:36]([n:37][c:38]4-[c:39]4[n:40][cH:41][cH:42][cH:43][cH:44]4)[CH2:45][CH2:46][CH2:47]5)[cH:29][cH:30][n:31][c:32]3[cH:33]2)[CH2:20][CH2:21]1)[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:16]1.[H-:1].[H-:4].[H-:5].[H-:6].[K+:63].[Li+:3].[Na+:64].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[CH3:15][N:17]1[CH2:18][CH:19]([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27]3[c:28](-[c:34]4[c:35]5[n:36]([n:37][c:38]4-[c:39]4[n:40][cH:41][cH:42][cH:43][cH:44]4)[CH2:45][CH2:46][CH2:47]5)[cH:29][cH:30][n:31][c:32]3[cH:33]2)[CH2:20][CH2:21]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 38061142,3-DihydroxybutanedioateHCID 693657753-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-quinolin-7-yloxymethyl]-pyrrolidine-1-carboxylic acid benzyl ester

Product 1

HCID 101807777-(1-Methyl-pyrrolidin-3-ylmethoxy)-4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)-quinoline

Sources & evidence

ORD record
ord-351d66ceb8aa43f5ab39c6c104985d1e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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