2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one结构式
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常用名 | 2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one | 英文名 | 2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one |
|---|---|---|---|---|
| CAS号 | 109740-09-2 | 分子量 | 261.27800 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C16H11N3O | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
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 | 2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one |
|---|
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。
| 分子式 | C16H11N3O |
|---|---|
| 分子量 | 261.27800 |
| 精确质量 | 261.09000 |
| PSA | 50.68000 |
| LogP | 2.86700 |
| InChIKey | ISMLHIIGSRUCOQ-UHFFFAOYSA-N |
| SMILES | O=c1[nH]c2ccccc2c2cn(-c3ccccc3)nc12 |
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。
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~98%
2-phenyl-5H-pyr... 109740-09-2 |
| 文献:Colotta, Vittoria; Capelli, Francesca; Lenzi, Ombretta; Catarzi, Daniela; Varano, Flavia; Poli, Daniela; Vincenzi, Fabrizio; Varani, Katia; Borea, Pier Andrea; Dal Ben, Diego; Volpini, Rosaria; Cristalli, Gloria; Filacchioni, Guido Bioorganic and Medicinal Chemistry, 2009 , vol. 17, # 1 p. 401 - 410 |
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~%
2-phenyl-5H-pyr... 109740-09-2 |
| 文献:3M INNOVATIVE PROPERTIES COMPANY Patent: WO2006/107771 A2, 2006 ; Location in patent: Page/Page column 55 ; |
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~%
2-phenyl-5H-pyr... 109740-09-2 |
| 文献:Catarzi, Daniela; Colotta, Vittoria; Varano, Flavia; Cecchi, Lucia; Filacchioni, Guido; Galli, Alessandro; Costagli, Chiara Archiv der Pharmazie, 1997 , vol. 330, # 12 p. 383 - 386 |
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~%
2-phenyl-5H-pyr... 109740-09-2 |
| 文献:Chang, En-Chiuan; Wen, Ya-Lan; Chang, Chun-Hsi; Shen, Yun-Hwei; Wen, Shaw-Bing; Yeh, Mou-Yung; Wong, Fung Fuh Tetrahedron, 2012 , vol. 68, # 29 p. 5920 - 5924 |
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。
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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
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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
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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
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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
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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
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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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
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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
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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
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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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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: 109740-09-2的SMILES表达式是什么? |
| A: 109740-09-2SMILES表达式为O=c1[nH]c2ccccc2c2cn(-c3ccccc3)nc12。 |
| Q: 109740-09-2的英文名称是什么? |
| A: 109740-09-2英文名称为2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-one。 |
| Q: 109740-09-2的CAS号是多少? |
| A: 109740-09-2CAS号为109740-09-2。 |
| Q: 109740-09-2的分子量是多少? |
| A: 109740-09-2分子量为261.27800。 |
| Q: 109740-09-2的分子式是什么? |
| A: 109740-09-2分子式为C16H11N3O。 |
| Q: 109740-09-2的LogP(油水分配系数)是多少? |
| A: 109740-09-2LogP(油水分配系数)为2.86700。 |
| Q: 109740-09-2的InChIKey是什么? |
| A: 109740-09-2InChIKey为ISMLHIIGSRUCOQ-UHFFFAOYSA-N。 |
| Q: 109740-09-2的极性表面积PSA是多少? |
| A: 109740-09-2极性表面积PSA为50.68000。 |
| Q: 109740-09-2的中文名称是什么? |
| A: 109740-09-2的中文名称为109740-09-2。 |
本表列出该化合物相关生产厂商、供应商信息,包含厂家名称、产品供应相关参考信息。
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