4-methyl-3-phenyl-1,3-thiazole-2-thione结构式
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常用名 | 4-methyl-3-phenyl-1,3-thiazole-2-thione | 英文名 | 4-methyl-3-phenyl-1,3-thiazole-2-thione |
|---|---|---|---|---|
| CAS号 | 5316-80-3 | 分子量 | 207.31500 | |
| 密度 | 1.32g/cm3 | 沸点 | 314.6ºC at 760 mmHg | |
| 分子式 | C10H9NS2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 144.1ºC |
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 | 3-Phenyl-4-methyl-3-penten-2-on |
|---|---|
| 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 | 1.32g/cm3 |
|---|---|
| 沸点 | 314.6ºC at 760 mmHg |
| 分子式 | C10H9NS2 |
| 分子量 | 207.31500 |
| 闪点 | 144.1ºC |
| 精确质量 | 207.01800 |
| PSA | 65.26000 |
| LogP | 3.57670 |
| InChIKey | ZWBWOUBEWNZPKJ-UHFFFAOYSA-N |
| SMILES | Cc1csc(=S)n1-c1ccccc1 |
| 折射率 | 1.723 |
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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~82%
4-methyl-3-phen... 5316-80-3 |
| 文献:Kasmi-Mir, Souad; Djafri, Ayada; Hamelin, Jack; Paquin, Ludovic; Bazureau, Jean Pierre; Rahmouni, Mustapha Synthetic Communications, 2007 , vol. 37, # 22 p. 4017 - 4034 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Bachetti Gazzetta Chimica Italiana, 1956 , vol. 86, p. 316,323 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Tripathy,H. et al. Journal of the Indian Chemical Society, 1973 , vol. 50, p. 417 - 419 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Kendall; Suggate Journal of the Chemical Society, 1949 , p. 1503,1505 Full Text Show Details Tripathy; Rout Journal of the Indian Chemical Society, 1959 , vol. 36, p. 590 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Bartoszewski,J. Roczniki Chemii, 1969 , vol. 43, # 2 p. 319 - 324 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Yano, Yumihiko; Tamura, Yoshiharu; Tagaki, Waichiro Bulletin of the Chemical Society of Japan, 1980 , vol. 53, # 3 p. 740 - 744 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Bartoszewski,J. Roczniki Chemii, 1969 , vol. 43, # 2 p. 319 - 324 |
|
~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Bartoszewski,J.; Jerzmanowska,Z. Roczniki Chemii, 1963 , vol. 37, p. 21 - 28 |
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~%
4-methyl-3-phen... 5316-80-3 |
| 文献:Bartoszewski,J.; Jerzmanowska,Z. Roczniki Chemii, 1963 , vol. 37, p. 21 - 28 |
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。
| 4-methyl-3-phenyl-1,3-thiazole-2-thione上游产品 8 | |
|---|---|
| 4-methyl-3-phenyl-1,3-thiazole-2-thione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: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:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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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: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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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。
| 3-phenyl-4-methyl-4-thiazoline-2-thione |
| 4-methyl-3-phenyl-3H-thiazole-2-thione |
| 4-methyl-3-phenyl-3-penten-2-one |
| 4-methyl-3-phenyl-1,3-thiazole-2(3H)-thione |
| 4-Methyl-3-phenyl-3H-thiazol-2-thion |
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: 5316-80-3的极性表面积PSA是多少? |
| A: 5316-80-3极性表面积PSA为65.26000。 |
| Q: 5316-80-3的分子式是什么? |
| A: 5316-80-3分子式为C10H9NS2。 |
| Q: 5316-80-3的分子量是多少? |
| A: 5316-80-3分子量为207.31500。 |
| Q: 5316-80-3的SMILES表达式是什么? |
| A: 5316-80-3SMILES表达式为Cc1csc(=S)n1-c1ccccc1。 |
| Q: 5316-80-3的上游原料有哪些? |
| A: 5316-80-3相关上游原料(CAS):75-15-0;78-95-5;103-72-0;24653-75-6;1074-52-8;67-64-1;22962-86-3;102-08-9。 |
| Q: 5316-80-3的LogP(油水分配系数)是多少? |
| A: 5316-80-3LogP(油水分配系数)为3.57670。 |
| Q: 5316-80-3的沸点是多少? |
| A: 5316-80-3沸点为314.6ºC at 760 mmHg。 |
| Q: 5316-80-3的InChIKey是什么? |
| A: 5316-80-3InChIKey为ZWBWOUBEWNZPKJ-UHFFFAOYSA-N。 |
| Q: 5316-80-3的CAS号是多少? |
| A: 5316-80-3CAS号为5316-80-3。 |
| Q: 5316-80-3有哪些英文别名? |
| A: 5316-80-3英文别名有:3-phenyl-4-methyl-4-thiazoline-2-thione、 4-methyl-3-phenyl-3H-thiazole-2-thione、 4-methyl-3-phenyl-3-penten-2-one、 4-methyl-3-phenyl-1,3-thiazole-2(3H)-thione、 4-Methyl-3-phenyl-3H-thiazol-2-thion。 |