Hydrochloric Acid → 1-{3-Chloro-6-[2-(3,3-difluoro-piperidin-1-yl)-ethoxy]-5-[3-(4-fluoro-phenyl)-butoxy]-4-methoxy-2-methyl-phenyl}-ethanone

HRID 92520

Reaction equation

HRID 92520 reaction equation
[Br:1][CH2:2][CH2:3][O:4][c:5]1[c:6]([C:27]([CH3:28])=[O:29])[c:7]([CH3:26])[c:8]([Cl:25])[c:9]([O:23][CH3:24])[c:10]1[O:11][CH2:12][CH2:13][CH:14]([CH3:15])[c:16]1[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]1.[ClH:30].[F:31][C:32]1([F:38])[CH2:33][NH:34][CH2:35][CH2:36][CH2:37]1>>[CH2:2]([CH2:3][O:4][c:5]1[c:6]([C:27]([CH3:28])=[O:29])[c:7]([CH3:26])[c:8]([Cl:25])[c:9]([O:23][CH3:24])[c:10]1[O:11][CH2:12][CH2:13][CH:14]([CH3:15])[c:16]1[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]1)[N:34]1[CH2:33][C:32]([F:31])([F:38])[CH2:37][CH2:36][CH2:35]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 27583503,3-DifluoropiperidineHCID 595835231-{2-(2-Bromo-ethoxy)-5-chloro-3-[3-(4-fluoro-phenyl)-butoxy]-4-methoxy-6-methyl-phenyl}-ethanone

Product 1

HCID 252548411-{3-Chloro-6-[2-(3,3-difluoro-piperidin-1-yl)-ethoxy]-5-[3-(4-fluoro-phenyl)-butoxy]-4-methoxy-2-methyl-phenyl}-ethanone

Sources & evidence

ORD record
ord-2c34d0d5642545dca797a5306df4549b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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