1-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]benzimidazole结构式
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常用名 | 1-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]benzimidazole | 英文名 | 1-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]benzimidazole |
|---|---|---|---|---|
| CAS号 | 55514-10-8 | 分子量 | 276.33600 | |
| 密度 | 1.24g/cm3 | 沸点 | 532ºC at 760 mmHg | |
| 分子式 | C17H16N4 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 275.6ºC |
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-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]benzimidazole |
|---|---|
| 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 | 1.24g/cm3 |
|---|---|
| 沸点 | 532ºC at 760 mmHg |
| 分子式 | C17H16N4 |
| 分子量 | 276.33600 |
| 闪点 | 275.6ºC |
| 精确质量 | 276.13700 |
| PSA | 35.64000 |
| LogP | 3.05080 |
| InChIKey | NLZJPFXHUPNNEK-UHFFFAOYSA-N |
| SMILES | Cn1c(Cc2nc3ccccc3n2C)nc2ccccc21 |
| 折射率 | 1.686 |
本表记录该化合物安全警示、防护措施、禁配物、处置方式等安全相关参考信息。
| 海关编码 | 2933990090 |
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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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~61%
1-methyl-2-[(1-... 55514-10-8 |
| 文献:Braussaud; Ruether; Cavell; Skelton; White Synthesis, 2001 , # 4 p. 626 - 632 |
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~58%
1-methyl-2-[(1-... 55514-10-8 |
| 文献:Elgafi, Sarah; Field, Leslie D.; Messerle, Barbara A.; Turner, Peter; Hambley, Trevor W. Journal of Organometallic Chemistry, 1999 , vol. 588, # 1 p. 69 - 77 |
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~%
1-methyl-2-[(1-... 55514-10-8 |
| 文献:Elgafi, Sarah; Field, Leslie D.; Messerle, Barbara A.; Turner, Peter; Hambley, Trevor W. Journal of Organometallic Chemistry, 1999 , vol. 588, # 1 p. 69 - 77 |
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~11%
1-methyl-2-[(1-... 55514-10-8
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| 文献:McKinnon, David M.; Spevack, Perry; Tipples, Graham Canadian Journal of Chemistry, 1988 , vol. 66, p. 2339 - 2344 |
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~%
1-methyl-2-[(1-... 55514-10-8 |
| 文献:Bradamante, Silvia; Facchetti, Antonio; Pagani, Giorgio A. Gazzetta Chimica Italiana, 1996 , vol. 126, # 6 p. 329 - 338 |
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。
| 上游产品 5 | |
|---|---|
| 下游产品 0 | |
本表展示该化学品海关编码、关税、监管条件等进出口海关参考数据。
| 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% |
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: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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实验名称:Absorbance-based primary biochemical high throughput screening assay to identify acti...
来源:The Scripps Research Institute Molecular Screening Center
靶标:caspase-3 preproprotein [Homo sapiens]
External Id:PROCASPASE3_ACT_EPIABS_1536_1X%ACT 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。
| 1,1'-dimethyl-1H,1'H-2,2'-methanediyl-bis-benzoimidazole |
| HMS2215F05 |
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: 55514-10-8的SMILES表达式是什么? |
| A: 55514-10-8SMILES表达式为Cn1c(Cc2nc3ccccc3n2C)nc2ccccc21。 |
| Q: 55514-10-8的分子式是什么? |
| A: 55514-10-8分子式为C17H16N4。 |
| Q: 55514-10-8的InChIKey是什么? |
| A: 55514-10-8InChIKey为NLZJPFXHUPNNEK-UHFFFAOYSA-N。 |
| Q: 55514-10-8的分子量是多少? |
| A: 55514-10-8分子量为276.33600。 |
| Q: 55514-10-8的沸点是多少? |
| A: 55514-10-8沸点为532ºC at 760 mmHg。 |
| Q: 55514-10-8的极性表面积PSA是多少? |
| A: 55514-10-8极性表面积PSA为35.64000。 |
| Q: 55514-10-8的上游原料有哪些? |
| A: 55514-10-8相关上游原料(CAS):61650-33-7;4760-34-3;105-53-3;612-28-2;1632-83-3。 |
| Q: 55514-10-8的中文名称是什么? |
| A: 55514-10-8的中文名称为55514-10-8。 |
| Q: 55514-10-8的CAS号是多少? |
| A: 55514-10-8CAS号为55514-10-8。 |
| Q: 55514-10-8的英文名称是什么? |
| A: 55514-10-8英文名称为1-methyl-2-[(1-methylbenzimidazol-2-yl)methyl]benzimidazole。 |