2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮结构式
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常用名 | 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮 | 英文名 | 1H-Benz[de]isoquinoline-1,3(2H)-dione,2-(phenylmethyl) |
|---|---|---|---|---|
| CAS号 | 2896-24-4 | 分子量 | 287.31200 | |
| 密度 | 1.336g/cm3 | 沸点 | 488.5ºC at 760mmHg | |
| 分子式 | C19H13NO2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 229.6ºC |
摘要:2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮(2-benzylbenzo[de]isoquinoline-1,3-dione),CAS号2896-24-4,分子式C19H13NO2,分子量287.31200,仅供科研实验参考,不作为医疗诊断与用药依据。
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。
| 中文名 | 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮 |
|---|---|
| 英文名 | 2-benzylbenzo[de]isoquinoline-1,3-dione |
| 英文别名 | 更多 |
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 | 1.336g/cm3 |
|---|---|
| 沸点 | 488.5ºC at 760mmHg |
| 分子式 | C19H13NO2 |
| 分子量 | 287.31200 |
| 闪点 | 229.6ºC |
| 精确质量 | 287.09500 |
| PSA | 39.07000 |
| LogP | 3.00100 |
| InChIKey | OIADVGWFJUXPCK-UHFFFAOYSA-N |
| SMILES | O=C1c2cccc3cccc(c23)C(=O)N1Cc1ccccc1 |
| 蒸汽压 | 1.08E-09mmHg at 25°C |
| 折射率 | 1.717 |
| 储存条件 | 室温 |
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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~99%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Beetz, Tom; Meuleman, Dick G.; Wieringa, Joop H. Journal of Medicinal Chemistry, 1982 , vol. 25, # 6 p. 714 - 719 |
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~80%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Takacs, Attila; Acs, Peter; Kollar, Laszlo Tetrahedron, 2008 , vol. 64, # 6 p. 983 - 987 |
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~65%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Chanmiya Sheikh; Takagi, Shunsuke; Ogasawara, Asako; Ohira, Masayuki; Miyatake, Ryuta; Abe, Hitoshi; Yoshimura, Toshiaki; Morita, Hiroyuki Tetrahedron, 2010 , vol. 66, # 12 p. 2132 - 2140 |
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~93%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Jaskowska, Jolanta; Kowalski, Piotr Journal of Heterocyclic Chemistry, 2008 , vol. 45, # 5 p. 1371 - 1375 |
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~82%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Kamal, Ahmed; Laxman; Rao, N. Venugopal Tetrahedron Letters, 1998 , vol. 39, # 47 p. 8733 - 8734 |
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~%
2-苄基-1H-苯并[de]异... 2896-24-4 |
| 文献:Jaubert Chemische Berichte, 1895 , vol. 28, p. 360 Gazzetta Chimica Italiana, 1895 , vol. 25 I, p. 248 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮上游产品 8 | |
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| 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮下游产品 1 | |
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: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.
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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。
| 2-Benzyl-benz[de]isochinolin-1,3-dion |
| 2-benzyl-benz[de]isoquinoline-1,3-dione |
| 2-Benzyl-benzo[de]isoquinoline-1,3-dione |
| 2-Benzyl-1H-benzo(de)isoquinoline-1,3(2H)-dione |
| N-(benzyl)-1,8-naphthalimide |
| N-benzylnapthalimide |
| F0074-0059 |
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: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的分子式是什么? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮分子式为C19H13NO2。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的分子量是多少? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮分子量为287.31200。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的沸点是多少? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮沸点为488.5ºC at 760mmHg。 |
| Q: 2896-24-4的中文名称是什么? |
| A: 2896-24-4的中文名称为2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的下游产品有哪些? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮相关下游产品(CAS):22817-26-1。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的上游原料有哪些? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮相关上游原料(CAS):81-84-5;100-46-9;1730-04-7;201230-82-2;5551-72-4;81-83-4;100-44-7;622-79-7。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的英文名称是什么? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮英文名称为2-benzylbenzo[de]isoquinoline-1,3-dione。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的LogP(油水分配系数)是多少? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮LogP(油水分配系数)为3.00100。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的InChIKey是什么? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮InChIKey为OIADVGWFJUXPCK-UHFFFAOYSA-N。 |
| Q: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮的极性表面积PSA是多少? |
| A: 2-苄基-1H-苯并[de]异喹啉-1,3(2H)-二酮极性表面积PSA为39.07000。 |
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。
| 上海阿拉丁生化科技股份有限公司 |
| 上海化源世纪贸易有限公司 |