Dimethyl Sulfoxide → 1-Cyclopropyl-6-fluoro-8-methoxy-7-(4-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

HRID 2145266

반응식

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

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 531671-Methylpiperazine

HCID 70194651-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acid

생성물 1

HCID 107382321-Cyclopropyl-6-fluoro-8-methoxy-7-(4-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

출처 및 근거

ORD 기록: ord-93c28f8a14af47f19dcf6f214ca280c5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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