2-苯基咪唑并[1,2-a]吡啶结构式
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常用名 | 2-苯基咪唑并[1,2-a]吡啶 | 英文名 | 2-phenylimidazo[1,2-a]pyridine |
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| CAS号 | 4105-21-9 | 分子量 | 194.23200 | |
| 密度 | 1.13g/cm3 | 沸点 | 245 °C/11 mmHg | |
| 分子式 | C13H10N2 | 熔点 | 135 °C | |
| MSDS | N/A | 闪点 | N/A |
| 中文名 | 2-苯基咪唑并[1,2-a]吡啶 |
|---|---|
| 英文名 | 2-phenylimidazo[1,2-a]pyridine |
| 中文别名 | 2-苯基-咪唑并[1,2-a]吡啶 |
| 英文别名 | 更多 |
| 密度 | 1.13g/cm3 |
|---|---|
| 沸点 | 245 °C/11 mmHg |
| 熔点 | 135 °C |
| 分子式 | C13H10N2 |
| 分子量 | 194.23200 |
| 精确质量 | 194.08400 |
| PSA | 17.30000 |
| LogP | 3.00130 |
| InChIKey | KDHWCFCNNGUJCP-UHFFFAOYSA-N |
| SMILES | c1ccc(-c2cn3ccccc3n2)cc1 |
| 外观性状 | 固体;White to Orange to Green powder to crystal |
| 折射率 | 1.638 |
| 储存条件 | 室温,干燥 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):3.4 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:1 5.互变异构体数量:无 6.拓扑分子极性表面积:17.3 7.重原子数量:15 8.表面电荷:0 9.复杂度:211 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 |
| 海关编码 | 2933990090 |
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| 2-苯基咪唑并[1,2-a]吡啶上游产品 10 | |
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| 2-苯基咪唑并[1,2-a]吡啶下游产品 9 | |
| 海关编码 | 2933990090 |
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| 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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来源:The Scripps Research Institute Molecular Screening Center
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External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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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:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
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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:Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
来源:24386
靶标:N/A
External Id:Sarm1 TIR NADase inhibitors
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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:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
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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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