Hydrochloric Acid → 5-(4-Fluorophenyl)-1-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-N,4-diphenyl-2-(propan-2-yl)-1H-pyrrole-3-carboxamide

HRID 306309Notes

Reaction equation

HRID 306309 reaction equation
[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[ClH:46].[Li+:45].[OH-:44].[OH:40][CH2:41][CH:42]=[CH2:43].[c:1]1([NH:7][C:8](=[O:9])[c:10]2[c:11]([CH:37]([CH3:38])[CH3:39])[n:12]([CH2:28][CH2:29][CH:30]3[O:31][C:32](=[O:36])[CH:33]=[CH:34][CH2:35]3)[c:13](-[c:21]3[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]3)[c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([NH:7][C:8](=[O:9])[c:10]2[c:11]([CH:37]([CH3:38])[CH3:39])[n:12]([CH2:28][CH2:29][CH:30]3[O:31][C:32](=[O:36])[CH2:33][CH:34]([OH:40])[CH2:35]3)[c:13](-[c:21]3[cH:22][cH:23][c:24]([F:27])[cH:25][cH:26]3)[c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 1140TolueneHCID 7858Allyl AlcoholHCID 28486Lithium ionHCID 22894764HCID 22894764, compound

Product 1

HCID 139236645-(4-Fluorophenyl)-1-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-N,4-diphenyl-2-(propan-2-yl)-1H-pyrrole-3-carboxamide

Sources & evidence

ORD record
ord-7869cf7be7a548de82bff4138f853195
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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