tert-Butyl piperazine-1-carboxylate → 6-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-5-chloronicotinic acid

반응식

[C:12]([CH3:13])([CH3:14])([CH3:15])[O:16][C:17](=[O:18])[N:19]1[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]1.[Cl:1][c:2]1[c:3]([Cl:11])[n:4][cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10]1>>[Cl:1][c:2]1[c:3]([N:22]2[CH2:21][CH2:20][N:19]([C:17]([O:16][C:12]([CH3:13])([CH3:14])[CH3:15])=[O:18])[CH2:24][CH2:23]2)[n:4][cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10]1

참가 물질

반응물 2

HCID 143452tert-Butyl piperazine-1-carboxylate

HCID 2479875,6-Dichloronicotinic acid

생성물 1

HCID 116098286-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-5-chloronicotinic acid

출처 및 근거

ORD 기록: ord-7e6a365a7a7f483e9fb584c3ca554e30
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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