Pyridine → 1-Ethyl-6-fluoro-7-[3-(2-furanyl)-1-piperazinyl]-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

반응식

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

참가 물질

반응물 3

HCID 1049Pyridine

HCID 4831697-Chloro-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HCID 167407772-(Furan-2-yl)piperazine

생성물 1

HCID 148393691-Ethyl-6-fluoro-7-[3-(2-furanyl)-1-piperazinyl]-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

출처 및 근거

ORD 기록: ord-779224db5b2b484487aef1212269afa5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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