苯并[c]吖啶结构式
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常用名 | 苯并[c]吖啶 | 英文名 | BENZ(C)ACRIDINE |
|---|---|---|---|---|
| CAS号 | 225-51-4 | 分子量 | 229.276 | |
| 密度 | 1.2±0.1 g/cm3 | 沸点 | 446.2±14.0 °C at 760 mmHg | |
| 分子式 | C17H11N | 熔点 | 132°C | |
| MSDS | N/A | 闪点 | 201.4±12.7 °C |
| 中文名 | 苯并[c]吖啶 |
|---|---|
| 英文名 | benzo[c]acridine |
| 中文别名 | 苯并(c)吖啶 |
| 英文别名 | 更多 |
| 密度 | 1.2±0.1 g/cm3 |
|---|---|
| 沸点 | 446.2±14.0 °C at 760 mmHg |
| 熔点 | 132°C |
| 分子式 | C17H11N |
| 分子量 | 229.276 |
| 闪点 | 201.4±12.7 °C |
| 精确质量 | 229.089142 |
| PSA | 12.89000 |
| LogP | 4.63 |
| InChIKey | OAPPEBNXKAKQGS-UHFFFAOYSA-N |
| SMILES | c1ccc2nc3c(ccc4ccccc43)cc2c1 |
| 蒸汽压 | 0.0±1.0 mmHg at 25°C |
| 折射率 | 1.783 |
| 储存条件 | 通风低温干燥 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):4.8 2.氢键供体数量:0 3.氢键受体数量:1 4.可旋转化学键数量:0 5.互变异构体数量:无 6.拓扑分子极性表面积:12.9 7.重原子数量:18 8.表面电荷:0 9.复杂度:300 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
| 危险品运输编码 | UN 2811 |
|---|---|
| 包装等级 | III |
| 危险类别 | 6.1(b) |
| 海关编码 | 2933990090 |
| 海关编码 | 2933990090 |
|---|---|
| 中文概述 | 2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0% |
| 申报要素 | 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期 |
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Substituted benz[a]acridines and benz[c]acridines as mammalian topoisomerase poisons.
Bioorg. Med. Chem. 8(5) , 1171-82, (2000) Coralyne and several other synthetic benzo[a,g]quinolizium derivatives related to protoberberine alkaloids have exhibited activity as topoisomerase poisons. These compounds are characterized by the pr... |
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Heteroatom effects in chemical carcinogenesis: effects of ring heteroatoms on ease of carbocation formation.
Cancer Biochem. Biophys. 7(1) , 53-60, (1983) The presence of a heteroatom can influence the ease with which a PAH diol-epoxide forms a triol carbocation. The influence of the heteroatom should be greatest when it is located where the PAH undergo... |
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Differentiated genotoxic response of carcinogenic and non-carcinogenic benzacridines and metabolites in rat hepatoma cells.
Carcinogenesis 6(3) , 455-7, (1985) Two closely related hepatoma cell lines were examined for their genotoxic response to benacridines and their metabolites by the appearance of alkaline labile DNA sites: H5, a dedifferentiated line exp... |
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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:Confirm compound inhibition to esBAF complex through repress target gene Fgf4 in qPCR...
来源:Broad Institute
靶标:N/A
External Id:2141-03_Inhibitor_SinglePoint_CherryPick_Activity
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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: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:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_Inhibitor_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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实验名称:HEK293 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-01_...
来源:Broad Institute
靶标:N/A
External Id:7071-01_Inhibitor_SinglePoint_CherryPick_Activity
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| 3,4-Benzacridine |
| Benzo[c]acridine |
| 3,4-Benzoacridine |
| BENZ(C)ACRIDINE |
| 12-Azabenz[a]anthracene |
| Benz[c]acridine |
| 7,8-Benzacridine |