1,3-二烯丙基-2-硫脲

• 常用名: 1,3-二烯丙基-2-硫脲
• 英文名: n,n'-diallylthiourea
• CAS号: 6601-20-3
• 分子量: 156.24900
• 密度: 0.995g/cm3
• 沸点: 209.8ºC at 760 mmHg
• 分子式: C₇H₁₂N₂S
• 熔点: 48-49ºC
• 闪点: 80.7ºC

1,3-二烯丙基-2-硫脲名称

• 中文名: 1,3-二烯丙基-2-硫脲
• 英文名: 1,3-bis(prop-2-enyl)thiourea
• 中文别名: N,N'-二烯丙基硫脲

1,3-二烯丙基-2-硫脲物理化学性质

• 密度: 0.995g/cm3
• 沸点: 209.8ºC at 760 mmHg
• 熔点: 48-49ºC
• 分子式: C₇H₁₂N₂S
• 分子量: 156.24900
• 闪点: 80.7ºC
• 精确质量: 156.07200
• PSA: 56.15000
• LogP: 1.60430
• InChIKey: DZZWKUMHMSNBSG-UHFFFAOYSA-N
• SMILES: C=CCNC(=S)NCC=C
• 折射率: 1.529
• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:2

  3.氢键受体数量:1

  4.可旋转化学键数量:4

  5.互变异构体数量:2

  6.拓扑分子极性表面积56.2

  7.重原子数量:10

  8.表面电荷:0

  9.复杂度:118

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

1,3-二烯丙基-2-硫脲安全信息

• 风险声明 (欧洲): R20/21/22;R36/37/38
• 安全声明 (欧洲): S26-S36/37/39
• 危险品运输编码: UN 2811
• 包装等级: III
• 危险类别: 6.1
• 海关编码: 2930909090

1,3-二烯丙基-2-硫脲海关

• 海关编码: 2930909090
• 中文概述: 2930909090. 其他有机硫化合物. 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:30.0%
• 申报要素: 品名, 成分含量, 用途
• Summary: 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

1,3-二烯丙基-2-硫脲靶点实验

查看更多实验

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

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

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

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

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

实验名称：Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ... 来源：ChEMBL 靶标：Klebsiella pneumoniae External Id：CHEMBL4296186

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：Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay 来源：24386 靶标：N/A External Id：Sarm1 TIR NADase inhibitors

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1,3-二烯丙基-2-硫脲英文别名

• Bisallylthiocarbamide
• N,N'-Diallyl-thioharnstoff
• N,N'-diallylthiocarbamide
• 1,3-bis(prop-2-en-1-yl)thiourea
• MFCD00014945
• N,N'-Bis-allylthiourea
• Diallylthiourea
• 1,3-Diallyl-2-thiourea
• Thiourea,N,N'-di-2-propenyl
• N,n'-diallylthiourea
• 1,3-Diallylthiourea