Hydrochloric Acid → N-[2,4-difluoro-5-(4-piperidinyl)phenyl]-2-methylpropanamide

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 312751,4-Dioxane

HCID 16757165Tert-butyl 4-[2,4-difluoro-5-(isobutyrylamino)phenyl]-1-piperidinecarboxylate

생성물 1

HCID 16757253N-[2,4-difluoro-5-(4-piperidinyl)phenyl]-2-methylpropanamide

출처 및 근거

ORD 기록: ord-466c11d8a01f483d953fac25ff28ce6e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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