Hydrochloric Acid → Methyl 4-[({[2-(4-fluorophenoxy)-5-(trifluoromethyl)pyridin-3-yl]carbonyl}amino)methyl]benzoate

HRID 142868

반응식

HRID 142868 반응식
[ClH:22].[F:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:10])[OH:11])[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][n:15]2)[cH:20][cH:21]1.[NH2:23][CH2:24][c:25]1[cH:26][cH:27][c:28]([C:29](=[O:30])[O:31][CH3:32])[cH:33][cH:34]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[c:8]([C:9](=[O:10])[NH:23][CH2:24][c:25]3[cH:26][cH:27][c:28]([C:29](=[O:30])[O:31][CH3:32])[cH:33][cH:34]3)[cH:12][c:13]([C:16]([F:17])([F:18])[F:19])[cH:14][n:15]2)[cH:20][cH:21]1

참가 물질

4

반응물 3

HCID 313Hydrochloric AcidHCID 571728Methyl 4-(aminomethyl)benzoateHCID 575723482-(4-Fluorophenoxy)-5-(trifluoromethyl)nicotinic acid

생성물 1

HCID 69048049Methyl 4-[({[2-(4-fluorophenoxy)-5-(trifluoromethyl)pyridin-3-yl]carbonyl}amino)methyl]benzoate

출처 및 근거

ORD 기록
ord-be99532e30524996a7126fbbaec1a916
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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