5-吡啶-4-基-4-邻甲苯基-4H-[1,2,4]三唑-3-硫醇

• 常用名: 5-吡啶-4-基-4-邻甲苯基-4H-[1,2,4]三唑-3-硫醇
• 英文名: 5-PYRIDIN-4-YL-4-O-TOLYL-4H-[1,2,4]TRIAZOLE-3-THIOL
• CAS号: 16629-41-7
• 分子量: 268.33700
• 密度: 1.3g/cm3
• 沸点: 400.5ºC at 760mmHg
• 分子式: C₁₄H₁₂N₄S
• 熔点: N/A
• 闪点: 196ºC

名称

• 中文名: 5-吡啶-4-基-4-邻甲苯基-4H-[1,2,4]三唑-3-硫醇
• 英文名: 4-(2-methylphenyl)-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

物理化学性质

• 密度: 1.3g/cm3
• 沸点: 400.5ºC at 760mmHg
• 分子式: C₁₄H₁₂N₄S
• 分子量: 268.33700
• 闪点: 196ºC
• 精确质量: 268.07800
• PSA: 82.40000
• LogP: 2.92640
• InChIKey: VDOCMXPONDDKGI-UHFFFAOYSA-N
• SMILES: Cc1ccccc1-n1c(-c2ccncc2)n[nH]c1=S
• 蒸汽压: 1.26E-06mmHg at 25°C
• 折射率: 1.704

安全信息

• 海关编码: 2933990090

海关

• 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%

靶点实验

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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：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

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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英文别名

• 5-Pyridin-4-yl-4-o-tolyl-4H-[1,2,4]triazole-3-thiol
• 5-pyridin-4-yl-4-o-tolyl-2,4-dihydro-[1,2,4]triazole-3-thione