Potassium Cation → [5-Methyl-2-({6-methoxy-7-[4-(4-tetrahydro-1-pyrrolylpiperidino)butoxy]-4-quinolyl}oxy)phenyl](phenyl)methanone

HRID 157882Notes

Reaction equation

HRID 157882 reaction equation
[C:46](=[O:47])([O-:48])[O-:49].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][O:6][c:7]1[c:8]([O:33][CH3:34])[cH:9][c:10]2[c:11]([O:17][c:18]3[c:19]([C:25](=[O:26])[c:27]4[cH:28][cH:29][cH:30][cH:31][cH:32]4)[cH:20][c:21]([CH3:24])[cH:22][cH:23]3)[cH:12][cH:13][n:14][c:15]2[cH:16]1.[K+:50].[K+:51].[N:35]1([CH:40]2[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]2)[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH2:52]>>[CH2:2]([CH2:3][CH2:4][CH2:5][O:6][c:7]1[c:8]([O:33][CH3:34])[cH:9][c:10]2[c:11]([O:17][c:18]3[c:19]([C:25](=[O:26])[c:27]4[cH:28][cH:29][cH:30][cH:31][cH:32]4)[cH:20][c:21]([CH3:24])[cH:22][cH:23]3)[cH:12][cH:13][n:14][c:15]2[cH:16]1)[N:43]1[CH2:42][CH2:41][CH:40]([N:35]2[CH2:36][CH2:37][CH2:38][CH2:39]2)[CH2:45][CH2:44]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 787034-(1-Pyrrolidinyl)piperidineHCID 57756358(2-{[7-(4-Chlorobutoxy)-6-methoxy-4-quinolyl]oxy}-5-methylphenyl)(phenyl)methanone

Product 1

HCID 57756547[5-Methyl-2-({6-methoxy-7-[4-(4-tetrahydro-1-pyrrolylpiperidino)butoxy]-4-quinolyl}oxy)phenyl](phenyl)methanone

Sources & evidence

ORD record
ord-7c81781c6c624dbd95ef5249e198e14d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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