2-吲哚啉硫酮结构式
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常用名 | 2-吲哚啉硫酮 | 英文名 | 3H-Indole-2-thiol |
|---|---|---|---|---|
| CAS号 | 496-30-0 | 分子量 | 149.213 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 243.4±43.0 °C at 760 mmHg | |
| 分子式 | C8H7NS | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 101.0±28.2 °C |
| 中文名 | 1,3-二氢-2H-吲哚-2-硫酮 |
|---|---|
| 英文名 | 1,3-dihydroindole-2-thione |
| 中文别名 | 2-吲哚啉硫酮 |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 243.4±43.0 °C at 760 mmHg |
| 分子式 | C8H7NS |
| 分子量 | 149.213 |
| 闪点 | 101.0±28.2 °C |
| 精确质量 | 149.029922 |
| PSA | 44.12000 |
| LogP | 1.46 |
| InChIKey | IGJWTYFTQNHSEK-UHFFFAOYSA-N |
| SMILES | S=C1Cc2ccccc2N1 |
| 蒸汽压 | 0.0±0.5 mmHg at 25°C |
| 折射率 | 1.693 |
| 储存条件 | 2-8°C, 干燥 |
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~94%
2-吲哚啉硫酮 496-30-0 |
| 文献:VIRONOVA AB; PETTERSSON, Birgitta; HASIMBEGOVIC, Vedran; SVENSSON, Per, H.; BERGMAN, Jan Patent: WO2012/104415 A1, 2012 ; Location in patent: Page/Page column 10 ; |
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~%
2-吲哚啉硫酮 496-30-0 |
| 文献:VIRONOVA AB; PETTERSSON, Birgitta; HASIMBEGOVIC, Vedran; SVENSSON, Per, H.; BERGMAN, Jan Patent: WO2012/104415 A1, 2012 ; Location in patent: Page/Page column 9; 10 ; |
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~%
2-吲哚啉硫酮 496-30-0 |
| 文献:Thanigaimalai, Pillaiyar; Lee, Ki-Cheul; Sharma, Vinay Kumar; Sharma, Niti; Roh, Eunmiri; Kim, Youngsoo; Jung, Sang-Hun Chemical and Pharmaceutical Bulletin, 2011 , vol. 59, # 10 p. 1285 - 1288 |
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~%
2-吲哚啉硫酮 496-30-0 |
| 文献:Sugasawa et al. Yakugaku Zasshi, 1938 , vol. 58, p. 139;engl.Ref.S.29 Chem.Abstr., 1938 , p. 4161 |
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~21%
2-吲哚啉硫酮 496-30-0 |
| 文献:Baudin, Jean-Bernard; Julia, Sylvestre A.; Lorne, Robert Bulletin de la Societe Chimique de France, 1987 , # 1 p. 181 - 188 |
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~55%
2-吲哚啉硫酮 496-30-0 |
| 文献:Rewcastle, Gordon W; Janosik, Tomasz; Bergman, Jan Tetrahedron, 2001 , vol. 57, # 33 p. 7185 - 7189 |
| 2-吲哚啉硫酮上游产品 6 | |
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| 2-吲哚啉硫酮下游产品 9 | |
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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: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:HSF-1 induced GFP reporter and Doxycycline induced RFP reporter Measured in Cell-Base...
来源:Broad Institute
靶标:Hsf1 protein
External Id:2038-03_Inhibitor_Dose_CherryPick_Activity_Set4
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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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| Benzazoline-2-thione |
| 1,3-Dihydro-indole-2-thione |
| 3H-Indole-2-thiol |
| indoline-2-thione |
| indoline-1-thione |
| 2-INDOLINETHIONE |
| 1,3-Dihydro-2H-indole-2-thione |
| indole-2-thione |