Dichloromethane → N-(azetidin-3-yl)-2-[[7-(pentafluoroethyl)isoquinolin-1-yl]amino]acetamide

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 86660469Tert-butyl 3-(2-[[7-(pentafluoroethyl)isoquinolin-1-yl]amino]acetamido)azetidine-1-carboxylate

생성물 1

HCID 86660470N-(azetidin-3-yl)-2-[[7-(pentafluoroethyl)isoquinolin-1-yl]amino]acetamide

출처 및 근거

ORD 기록: ord-0c22430449b141cda3c02849e2420728
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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