4-苄基-5-(2-氯苯基)-4H-[1,2,4]噻唑-3-硫醇

• 常用名: 4-苄基-5-(2-氯苯基)-4H-[1,2,4]噻唑-3-硫醇
• 英文名: 4-BENZYL-5-(2-CHLORO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL
• CAS号: 23282-94-2
• 分子量: 301.79400
• 密度: 1.33g/cm3
• 沸点: 425.8ºC at 760mmHg
• 分子式: C₁₅H₁₂ClN₃S
• 熔点: N/A
• 闪点: 211.3ºC

名称

• 中文名: 4-苄基-5-(2-氯苯基)-4H-[1,2,4]噻唑-3-硫醇
• 英文名: 4-benzyl-3-(2-chlorophenyl)-1H-1,2,4-triazole-5-thione

物理化学性质

• 密度: 1.33g/cm3
• 沸点: 425.8ºC at 760mmHg
• 分子式: C₁₅H₁₂ClN₃S
• 分子量: 301.79400
• 闪点: 211.3ºC
• 精确质量: 301.04400
• PSA: 69.51000
• LogP: 3.93550
• InChIKey: KDDNIZALMTWHOV-UHFFFAOYSA-N
• SMILES: S=c1[nH]nc(-c2ccccc2Cl)n1Cc1ccccc1
• 蒸汽压: 1.86E-07mmHg at 25°C
• 折射率: 1.683

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：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.

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

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

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

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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英文别名

• 4-benzyl-5-(2-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
• 4-benzyl-5-(2-chloro-phenyl)-2,4-dihydro-[1,2,4]triazole-3-thione
• 5-(2-Chlor-phenyl)-4-benzyl-3-mercapto-4H-1.2.4-triazol
• 4-Benzyl-5-(2-chloro-phenyl)-4H-[1,2,4]triazole-3-thiol