8,9,10,11-Tetrahydro[1]benzothieno[3,2-E][1,2,4]triazolo[4,3-c]pyrimidine结构式
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常用名 | 8,9,10,11-Tetrahydro[1]benzothieno[3,2-E][1,2,4]triazolo[4,3-c]pyrimidine | 英文名 | 8,9,10,11-Tetrahydro[1]benzothieno[3,2-E][1,2,4]triazolo[4,3-c]pyrimidine |
|---|---|---|---|---|
| CAS号 | 40106-82-9 | 分子量 | 230.28900 | |
| 密度 | 1.7g/cm3 | 沸点 | N/A | |
| 分子式 | C11H10N4S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
摘要:8,9,10,11-四氢[1]苯并噻吩[3,2-E][1,2,4]三唑[4,3-c]嘧啶,中文名称未提供,CAS号为40106-82-9,分子式为C11H10N4S,分子量为230.28900。仅供科研实验参考,不作为医疗或临床使用依据。
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。
| 英文名 | 8,9,10,11-Tetrahydro[1]benzothieno[3,2-E][1,2,4]triazolo[4,3-c]pyrimidine |
|---|---|
| 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 | 1.7g/cm3 |
|---|---|
| 分子式 | C11H10N4S |
| 分子量 | 230.28900 |
| 精确质量 | 230.06300 |
| PSA | 71.32000 |
| LogP | 2.21780 |
| InChIKey | GOMHVJXSMQEXRS-UHFFFAOYSA-N |
| SMILES | c1nnc2c3c4c(sc3ncn12)CCCC4 |
| 折射率 | 1.923 |
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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~83%
8,9,10,11-Tetra... 40106-82-9 |
| 文献:Ismail; Aboulwafa; Koreish Farmaco, 1995 , vol. 50, # 9 p. 611 - 616 |
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~%
8,9,10,11-Tetra... 40106-82-9 |
| 文献:Robba,M. et al. Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques, 1973 , vol. 276, p. 93 - 95 |
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~%
8,9,10,11-Tetra... 40106-82-9 |
| 文献:Arya,V.P. Indian Journal of Chemistry, 1972 , vol. 10, p. 1141 - 1150 |
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~86%
8,9,10,11-Tetra... 40106-82-9 |
| 文献:Shishoo, C. J.; Devani, M. B.; Ullas, G. V.; Anathan, S.; Bhadti, V. S. Journal of Heterocyclic Chemistry, 1981 , vol. 18, p. 43 - 46 |
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:HTS to identify inhibitors of TNF-alpha Induced Cell Death in Jurkat FADD-/- Cells.
来源:University of Pittsburgh Molecular Library Screening Center
靶标:N/A
External Id:MH081226: Primary HTS for Inhibitors of a Novel Necrotic Cell Death Pathway # Jurkat FADD-/- Model.
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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:uHTS identification of small molecule inhibitors of tim23-1 yeast via a luminescent a...
来源:Burnham Center for Chemical Genomics
靶标:TPA: Essential component of the Translocase of the Inner Mitochondrial membrane (TIM23 complex); involved in protein import into mitochondrial matrix and inner membrane; with Tim17p, contributes to architecture and function of the import channel [Saccharomyces cerevisiae S288c]
External Id:SBCCG-A419-tim23-1-Primary-Antagonist-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:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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实验名称:uHTS identification of small molecule inhibitors of tim10-1 yeast via a luminescent a...
来源:Burnham Center for Chemical Genomics
靶标:TPA: Essential protein of the mitochondrial intermembrane space, forms a complex with Tim9p (TIM10 complex) that delivers hydrophobic proteins to the TIM22 complex for insertion into the inner membrane [Saccharomyces cerevisiae S288c]
External Id:SBCCG-A413-tim10-1-Primary-Antagonist-Assay
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实验名称:384-well Z-Lyte format Hck-Nef inhibitor HTS run at the PMLSC
来源:University of Pittsburgh Molecular Library Screening Center
靶标:N/A
External Id:MH083223 Targeting HIV-1 Nef with Small Molecules
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实验名称:uHTS identification of APOBEC3A DNA Deaminase Inhibitors via a fluorescence-based sin...
来源:Burnham Center for Chemical Genomics
靶标:probable DNA dC->dU-editing enzyme APOBEC-3A [Homo sapiens]
External Id:SBCCG-A539-APOBEC3A-Inhibitor-Primary-Assay
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实验名称:Identification of CBX7 inhibitors - Primary Alpha Screen
来源:15290
靶标:N/A
External Id:CBX7-Alpha-primary
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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。
| 1,2,4-Triazolo<3,4-c>pyrimidino<4,5-b>tetrahydrobenzo<b>thiophene |
| 8,9,10,11-Tetrahydrobenzo<b>thieno<2,3-d>pyrimido<3,4-a>-s-triazol |
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: 40106-82-9的SMILES表达式是什么? |
| A: 40106-82-9SMILES表达式为c1nnc2c3c4c(sc3ncn12)CCCC4。 |
| Q: 40106-82-9的上游原料有哪些? |
| A: 40106-82-9相关上游原料(CAS):64-18-6;40106-45-4;40493-18-3;14346-24-8;122-51-0。 |
| Q: 40106-82-9的分子量是多少? |
| A: 40106-82-9分子量为230.28900。 |
| Q: 40106-82-9的InChIKey是什么? |
| A: 40106-82-9InChIKey为GOMHVJXSMQEXRS-UHFFFAOYSA-N。 |
| Q: 40106-82-9的英文名称是什么? |
| A: 40106-82-9英文名称为8,9,10,11-Tetrahydro[1]benzothieno[3,2-E][1,2,4]triazolo[4,3-c]pyrimidine。 |
| Q: 40106-82-9的中文名称是什么? |
| A: 40106-82-9的中文名称为40106-82-9。 |
| Q: 40106-82-9的LogP(油水分配系数)是多少? |
| A: 40106-82-9LogP(油水分配系数)为2.21780。 |
| Q: 40106-82-9的极性表面积PSA是多少? |
| A: 40106-82-9极性表面积PSA为71.32000。 |
| Q: 40106-82-9的CAS号是多少? |
| A: 40106-82-9CAS号为40106-82-9。 |
| Q: 40106-82-9的分子式是什么? |
| A: 40106-82-9分子式为C11H10N4S。 |