N-苯基异烟酰胺

• 常用名: N-苯基异烟酰胺
• 英文名: N-Phenylisonicotinamide
• CAS号: 3034-31-9
• 分子量: 198.22100
• 密度: 1.227g/cm3
• 沸点: 265.8ºC at 760mmHg
• 分子式: C₁₂H₁₀N₂O
• 熔点: 170-172ºC
• 闪点: 114.5ºC

N-苯基异烟酰胺名称

• 中文名: 异烟酰苯胺
• 英文名: N-phenylpyridine-4-carboxamide
• 中文别名: N-苯基吡啶-4-甲酰胺

N-苯基异烟酰胺物理化学性质

• 密度: 1.227g/cm3
• 沸点: 265.8ºC at 760mmHg
• 熔点: 170-172ºC
• 分子式: C₁₂H₁₀N₂O
• 分子量: 198.22100
• 闪点: 114.5ºC
• 精确质量: 198.07900
• PSA: 41.99000
• LogP: 2.40690
• InChIKey: FCTZHFATVFONMW-UHFFFAOYSA-N
• SMILES: O=C(Nc1ccccc1)c1ccncc1
• 折射率: 1.65
• 储存条件: 室温，保存在惰性气体中
• 分子结构:

  1、 摩尔折射率：58.91

  2、 摩尔体积（cm³/mol）：161.5

  3、 等张比容（90.2K）：441.0

  4、 表面张力（dyne/cm）：55.5

  5、 极化率（10-24cm3）：23.35

• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:1

  3.氢键受体数量:2

  4.可旋转化学键数量:2

  5.互变异构体数量:2

  6.拓扑分子极性表面积42

  7.重原子数量:15

  8.表面电荷:0

  9.复杂度:206

  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

N-苯基异烟酰胺安全信息

• 海关编码: 2933399090

N-苯基异烟酰胺海关

• 海关编码: 2933399090
• 中文概述: 2933399090. 其他结构含非稠合吡啶环的化合物. 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: 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

N-苯基异烟酰胺靶点实验

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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

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：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

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：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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N-苯基异烟酰胺英文别名

• Isonicotinanilide
• N-phenyl-4-pyridinecarboxamide
• pyridine-4-carboxylic acid phenylamide
• N-Phenyl isonicotinicamide
• N-phenyl-4-pyridylcarboxamide