4,5-dihydro-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-3-amine

• 常用名: 4,5-dihydro-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-3-amine
• 英文名: 4,5-dihydro-1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-3-amine
• CAS号: 66000-40-6
• 分子量: 229.20
• 密度: 1.4±0.1 g/cm3
• 沸点: 308.5±52.0 °C at 760 mmHg
• 分子式: C₁₀H₁₀F₃N₃
• 熔点: N/A
• 闪点: 140.4±30.7 °C

用途

BW 755C是一种5-脂氧合酶(5-LO)抑制剂,其IC50为5μM。BW 755C还抑制环氧合酶(COX),对COX-1和COX-2的IC50分别为0.65和1.2μg/mL[1][2]。

名称

• 英文名: 2-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazol-5-amine

生物活性

• 描述: BW 755C是一种5-脂氧合酶(5-LO)抑制剂,其IC50为5μM。BW 755C还抑制环氧合酶(COX),对COX-1和COX-2的IC50分别为0.65和1.2μg/mL[1][2]。
• 相关类别:
  研究领域 >> 内分泌
  信号通路 >> 免疫及炎症 >> COX
  信号通路 >> 代谢酶/蛋白酶 >> 5脂氧合酶
• 靶点实验:

  5-LO:5 μM (IC50)

  COX-1:0.65 μg/mL (IC50)

  COX-2:1.2 μg/mL (IC50)

• 体内研究: 体重755C(0.03-10 mg/大鼠；皮下注射；一次)抑制大鼠排卵率及卵巢 五合一和 12赫水平[3] 动物模型：幼龄Wistar大鼠~22日龄[3]剂量：0.03、0.1、0.3、1.0、3.1和10mg/只给药：皮下注射,一次结果：5-HETE(中度)和12-HETE(强烈)降低。
• 参考文献:

  [1]. Hlasta DJ, et al. 5-Lipoxygenase inhibitors: the synthesis and structure-activity relationships of a series of 1-phenyl-3-pyrazolidinones. J Med Chem. 1991 May;34(5):1560-70.

  [2]. Mitchell JA, et al. Selectivity of nonsteroidal antiinflammatory drugs as inhibitors of constitutive and inducible cyclooxygenase. Proc Natl Acad Sci U S A. 1993 Dec 15;90(24):11693-7.

  [3]. Tanaka N, et al. Comparison of inhibitory actions of indomethacin and epostane on ovulation in rats. Am J Physiol. 1991 Feb;260(2 Pt 1):E170-4.

物理化学性质

• 密度: 1.4±0.1 g/cm3
• 沸点: 308.5±52.0 °C at 760 mmHg
• 分子式: C₁₀H₁₀F₃N₃
• 分子量: 229.20
• 闪点: 140.4±30.7 °C
• 精确质量: 229.082687
• PSA: 39.12000
• LogP: 1.94
• InChIKey: CPXGGWXJNQSFEP-UHFFFAOYSA-N
• SMILES: NC1=NN(c2cccc(C(F)(F)F)c2)CC1
• 蒸汽压: 0.0±0.7 mmHg at 25°C
• 折射率: 1.559
• 储存条件: 室温

安全信息

• 海关编码: 2933199090

海关

• 海关编码: 2933199090
• 中文概述: 2933199090. 其他结构上有非稠合吡唑环化合物. 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: 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

靶点实验

查看更多实验

实验名称：In vitro for prostaglandin G/H synthase inhibitory activity against rat basophil leuk... 来源：ChEMBL 靶标：Prostaglandin G/H synthase 1 External Id：CHEMBL764933

实验名称：In vivo inhibition of AA induced ear oedema in mice following topical administration. 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL878375

实验名称：Compound was tested for its oral antiinflammatory activity in the rat carrageenan paw... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL779951

实验名称：Inhibition of ovine seminal vesicle prostaglandin synthetase 来源：ChEMBL 靶标：Prostaglandin G/H synthase 1 External Id：CHEMBL766130

实验名称：Inhibitory activity against 5-lipoxygenase obtained from rat basophilic leukemia cell... 来源：ChEMBL 靶标：Polyunsaturated fatty acid 5-lipoxygenase External Id：CHEMBL619225

实验名称：Inhibitory activity against polymorphonuclear cell phospholipase-A2 in rat 来源：ChEMBL 靶标：Phospholipase A2 External Id：CHEMBL765138

实验名称：In vivo inhibition of ear oedema in mice following p.o. administration. 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL739777

实验名称：In vitro methemoglobin Induction at 10e-4 M in lysed human red blood cells 来源：ChEMBL 靶标：N/A External Id：CHEMBL699795

实验名称：Tested for effect on the production of Lipoxygenase (LO) metabolite, 5,12-diHETE in g... 来源：ChEMBL 靶标：Cavia porcellus External Id：CHEMBL689008

实验名称：Inhibition of rat basophilic leukemia cell 5-lipoxygenase 来源：ChEMBL 靶标：Polyunsaturated fatty acid 5-lipoxygenase External Id：CHEMBL619913

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英文别名

• BW-755C
• 1-(m-trifluoromethylphenyl)-3-amino-2-pyrazoline
• 1-[3-(trifluoromethyl)phenyl]-3-amino-2-pyrazoline
• 3-amino-1-[m-(trifluoromethyl)phenyl]-2-pyrazoline
• 4,5-Dihydro-1-(3-(trifluoromethyl)phenyl)-1H-pyrazol-3-amine
• 1-(3-trifluoromethylphenyl)-4,5-dihydro-1H-pyrazol-3-amine
• 1-[3-(Trifluoromethyl)phenyl]-4,5-dihydro-1H-pyrazol-3-amine
• 4,5-dihydro-1-(3-(trifluoromethyl)-phenyl)-1H-pyrazol-3-amine
• T0504-7356
• 3-amino-1-(3-trifluoromethylphenyl)-2-pyrazoline