Hydrochloric Acid → 4-(1-((4-(1-Methylcarbamoyl-1H-indol-5-yloxy)pyridin-2-yl)aminocarbonyl)piperidin-4-yl)butyric acid

HRID 1237016Notes

Reaction equation

HRID 1237016 reaction equation
[CH3:1][NH:2][C:3](=[O:4])[n:5]1[cH:6][cH:7][c:8]2[cH:9][c:10]([O:14][c:15]3[cH:16][c:17]([NH:21][C:22](=[O:23])[N:24]4[CH2:25][CH2:26][CH:27]([CH2:30][CH2:31][CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH2:28][CH2:29]4)[n:18][cH:19][cH:20]3)[cH:11][cH:12][c:13]12.[CH3:46][OH:47].[ClH:40].[Li+:38].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH-:39]>>[CH3:1][NH:2][C:3](=[O:4])[n:5]1[cH:6][cH:7][c:8]2[cH:9][c:10]([O:14][c:15]3[cH:16][c:17]([NH:21][C:22](=[O:23])[N:24]4[CH2:25][CH2:26][CH:27]([CH2:30][CH2:31][CH2:32][C:33](=[O:34])[OH:35])[CH2:28][CH2:29]4)[n:18][cH:19][cH:20]3)[cH:11][cH:12][c:13]12

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 210548675-(2-(((4-(3-Ethoxycarbonylpropyl)piperidin-1-yl)carbonyl)amino)pyridin-4-yloxy)-1H-indole-1-carboxylic acid methylamide

Product 1

HCID 219493124-(1-((4-(1-Methylcarbamoyl-1H-indol-5-yloxy)pyridin-2-yl)aminocarbonyl)piperidin-4-yl)butyric acid

Sources & evidence

ORD record
ord-dfd47e117a744e2aa17556b9ecdab243
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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