1-(2,4-Xylyl)piperazine → (4-Bromo-3-chlorophenyl)[4-(2,4-dimethylphenyl)piperazin-1-yl]methanone

반응식

[Br:1][c:2]1[c:3]([Cl:11])[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[CH3:12][c:13]1[c:14]([N:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[cH:15][cH:16][c:17]([CH3:19])[cH:18]1>>[Br:1][c:2]1[c:3]([Cl:11])[cH:4][c:5]([C:6](=[O:8])[N:23]2[CH2:22][CH2:21][N:20]([c:14]3[c:13]([CH3:12])[cH:18][c:17]([CH3:19])[cH:16][cH:15]3)[CH2:25][CH2:24]2)[cH:9][cH:10]1

참가 물질

반응물 2

HCID 705441-(2,4-Xylyl)piperazine

HCID 125943024-Bromo-3-chlorobenzoic acid

생성물 1

HCID 58484864(4-Bromo-3-chlorophenyl)[4-(2,4-dimethylphenyl)piperazin-1-yl]methanone

출처 및 근거

ORD 기록: ord-c4ad9c1434034a71b868a5e2750ffd61
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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