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1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid

更新时间:2025-09-18 12:06:12

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式
1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式
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常用名 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid 英文名 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
CAS号 108138-27-8 分子量 403.35500
密度 1.48g/cm3 沸点 611ºC at 760 mmHg
分子式 C20H16F3N3O3 熔点 N/A
MSDS N/A 闪点 323.3ºC

 名称

英文名 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
英文别名 更多

 物理化学性质

密度 1.48g/cm3
沸点 611ºC at 760 mmHg
分子式 C20H16F3N3O3
分子量 403.35500
闪点 323.3ºC
精确质量 403.11400
PSA 74.57000
LogP 2.90960
InChIKey AAMFCDRGHVWGAW-UHFFFAOYSA-N
SMILES O=C(O)c1cn(-c2ccc(F)cc2F)c2cc(N3CCNCC3)c(F)cc2c1=O
蒸汽压 8.74E-16mmHg at 25°C
折射率 1.62

 合成线路

~46%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

~%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

~%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

~%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

~%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

~%

1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid结构式

1-(2,4-difluoro...

108138-27-8

文献:Renau, Thomas E.; Sanchez, Joseph P.; Shapiro, Martin A.; Dever, Julie A.; Gracheck, Stephen J.; Domagala, John M. Journal of Medicinal Chemistry, 1995 , vol. 38, # 15 p. 2974 - 2977

 靶点实验

查看更多实验

实验名称:Minimum inhibitory concentration against Escherichia coli
来源:ChEMBL
靶标:Escherichia coli
External Id:CHEMBL679318
实验名称:Antibacterial activity was determined against gram positive organism, Streptococcus f...
来源:ChEMBL
靶标:Enterococcus faecalis
External Id:CHEMBL799852
实验名称:Anti-bacterial activity tested against Gram-negative PA-7 bacterium
来源:ChEMBL
靶标:Pseudomonas aeruginosa
External Id:CHEMBL771949
实验名称:Anti-bacterial activity was tested against Gram-positive SA-13 bacterium
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL807339
实验名称:Anti-bacterial activity tested against Mycobacterium fortuitum (ATCG 6841)
来源:ChEMBL
靶标:Mycolicibacterium fortuitum
External Id:CHEMBL748677
实验名称:Calculated partition coefficient (clogP)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL631421
实验名称:Mammalian cell cytotoxicity test in chinese hamster V79 cells (clonogenic cytotoxicit...
来源:ChEMBL
靶标:V79
External Id:CHEMBL662294
实验名称:Antibacterial activity was determined against gram negative organism, Providencia ret...
来源:ChEMBL
靶标:Bacteria
External Id:CHEMBL755846
实验名称:Dissociation constant (pKa2)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL634053
实验名称:Calculated partition coefficient (clogP)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL622147
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 英文别名

t 1814
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