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3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)

更新时间:2025-09-11 00:29:59

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式
3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式
委托求购
常用名 3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl) 英文名 3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)
CAS号 35975-86-1 分子量 279.29000
密度 1.358g/cm3 沸点 459.1ºC at 760mmHg
分子式 C17H13NO3 熔点 N/A
MSDS N/A 闪点 231.5ºC

 名称

本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。

英文名 1-benzyl-4-oxoquinoline-3-carboxylic acid
英文别名 更多

 物理化学性质

本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。

密度 1.358g/cm3
沸点 459.1ºC at 760mmHg
分子式 C17H13NO3
分子量 279.29000
闪点 231.5ºC
精确质量 279.09000
PSA 59.30000
LogP 2.74800
InChIKey CCWROOWBCZEPAQ-UHFFFAOYSA-N
SMILES O=C(O)c1cn(Cc2ccccc2)c2ccccc2c1=O
折射率 1.671

 合成线路

本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。

~75%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Stern, Eric; Muccioli, Giulio G.; Bosier, Barbara; Hamtiaux, Laurie; Millet, Regis; Poupaert, Jacques H.; Henichart, Jean-Pierre; Depreux, Patrick; Goossens, Jean-Francois; Lambert, Didier M. Journal of Medicinal Chemistry, 2007 , vol. 50, # 22 p. 5471 - 5484

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Sayyed; Panse; Bhawal; Deshmukh Synthetic Communications, 2000 , vol. 30, # 14 p. 2533 - 2540

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Stern, Eric; Muccioli, Giulio G.; Millet, Regis; Goossens, Jean-Francois; Farce, Amaury; Chavatte, Philippe; Poupaert, Jacques H.; Lambert, Didier M.; Depreux, Patrick; Henichart, Jean-Pierre Journal of Medicinal Chemistry, 2006 , vol. 49, # 1 p. 70 - 79

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Stern, Eric; Muccioli, Giulio G.; Millet, Regis; Goossens, Jean-Francois; Farce, Amaury; Chavatte, Philippe; Poupaert, Jacques H.; Lambert, Didier M.; Depreux, Patrick; Henichart, Jean-Pierre Journal of Medicinal Chemistry, 2006 , vol. 49, # 1 p. 70 - 79

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Sayyed; Panse; Bhawal; Deshmukh Synthetic Communications, 2000 , vol. 30, # 14 p. 2533 - 2540

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Sayyed; Panse; Bhawal; Deshmukh Synthetic Communications, 2000 , vol. 30, # 14 p. 2533 - 2540

~%

3-Quinolinecarboxylicacid, 1,4-dihydro-4-oxo-1-(phenylmethyl)结构式

3-Quinolinecarb...

35975-86-1

查看详情
文献:Bohnert, Sabine; Guendel, Wolf-H. Zeitschrift fuer Naturforschung, B: Chemical Sciences, 1987 , vol. 42, # 9 p. 1159 - 1166

 靶点实验

查看更多实验

本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。

实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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 英文别名

本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。

1-benzyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acide
1-benzyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid
N-Benzyl-4-oxo-3-chinolincarbonsaeure
1-benzyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
1-Benzyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
1-benzyl-3-quinolinecarboxylic acid-4-one
1-benzyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

 常见问题

本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。

Q: 35975-86-1的分子量是多少?
A: 35975-86-1分子量为279.29000。
Q: 35975-86-1的InChIKey是什么?
A: 35975-86-1InChIKey为CCWROOWBCZEPAQ-UHFFFAOYSA-N。
Q: 35975-86-1的SMILES表达式是什么?
A: 35975-86-1SMILES表达式为O=C(O)c1cn(Cc2ccccc2)c2ccccc2c1=O。
Q: 35975-86-1的上游原料有哪些?
A: 35975-86-1相关上游原料(CAS):19112-35-7;54535-22-7;52980-28-6;289706-52-1;289706-56-5;100-39-0。
Q: 35975-86-1的CAS号是多少?
A: 35975-86-1CAS号为35975-86-1。
Q: 35975-86-1的LogP(油水分配系数)是多少?
A: 35975-86-1LogP(油水分配系数)为2.74800。
Q: 35975-86-1的极性表面积PSA是多少?
A: 35975-86-1极性表面积PSA为59.30000。
Q: 35975-86-1的沸点是多少?
A: 35975-86-1沸点为459.1ºC at 760mmHg。
Q: 35975-86-1的中文名称是什么?
A: 35975-86-1的中文名称为35975-86-1。
Q: 35975-86-1的分子式是什么?
A: 35975-86-1分子式为C17H13NO3。
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