Trifluoroacetic acid → N-[5-(5-amino-2-chloro-4-fluorophenoxy)[1,3]thiazolo[5,4-b]pyridin-2-yl]propanamide

반응식

[C:1]([N:5]([C:2](=[O:3])[O-:4])[c:9]1[c:10]([F:31])[cH:11][c:12]([Cl:30])[c:13]([O:15][c:16]2[cH:17][cH:18][c:19]3[c:20]([n:21]2)[s:22][c:23]([NH:25][C:26]([CH2:27][CH3:28])=[O:29])[n:24]3)[cH:14]1)([CH3:6])([CH3:7])[CH3:8].[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[NH2:5][c:9]1[c:10]([F:31])[cH:11][c:12]([Cl:30])[c:13]([O:15][c:16]2[cH:17][cH:18][c:19]3[c:20]([n:21]2)[s:22][c:23]([NH:25][C:26]([CH2:27][CH3:28])=[O:29])[n:24]3)[cH:14]1

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 178460094N-tert-butyl-N-[4-chloro-2-fluoro-5-[[2-(propanoylamino)-[1,3]thiazolo[5,4-b]pyridin-5-yl]oxy]phenyl]carbamate

생성물 1

HCID 86646047N-[5-(5-amino-2-chloro-4-fluorophenoxy)[1,3]thiazolo[5,4-b]pyridin-2-yl]propanamide

출처 및 근거

ORD 기록: ord-fe626736da00462182f3590a48d60a8f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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