3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one

• 常用名: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one
• 英文名: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one
• CAS号: 107746-52-1
• 分子量: 331.44900
• 密度: 1.1g/cm3
• 沸点: 409.2ºC at 760mmHg
• 分子式: C₂₀H₂₉NO₃
• 熔点: N/A
• 闪点: 201.2ºC

名称

• 英文名: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-methoxypyrrolidin-2-one

物理化学性质

• 密度: 1.1g/cm3
• 沸点: 409.2ºC at 760mmHg
• 分子式: C₂₀H₂₉NO₃
• 分子量: 331.44900
• 闪点: 201.2ºC
• 精确质量: 331.21500
• PSA: 49.77000
• LogP: 4.10220
• InChIKey: NJTQENWDJVHUOX-GXDHUFHOSA-N
• SMILES: CON1CCC(=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O
• 蒸汽压: 2.8E-07mmHg at 25°C
• 折射率: 1.556

靶点实验

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实验名称：In vivo inflammatory activity measured on Gastric ulcerogenicity, expressed as percen... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL775282

实验名称：Percent of rats with ulcers after the administration of compound at a dose of 10 oral... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL796465

实验名称：Compound was evaluated for edema density in adjuvant-induced arthritis model in rats ... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL795239

实验名称：Compound is evaluated for inhibitory effect on the generation of Leukotriene B4 (LTB4... 来源：ChEMBL 靶标：Homo sapiens External Id：CHEMBL700001

实验名称：Compound was evaluated for edema density in adjuvant-induced arthritis model in rats ... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL795869

实验名称：Inhibition of 5-lipoxygenase in intact rat basophilic leukemia cells stimulated with ... 来源：ChEMBL 靶标：Polyunsaturated fatty acid 5-lipoxygenase External Id：CHEMBL618070

实验名称：Antiinflammatory activity expressed as minimum effective dose was screened by using a... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL793939

实验名称：Compound is evaluated for inhibitory effect on the generation of Prostaglandin E2 (PG... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL782879

实验名称：Compound is evaluated for gastric ulceration in rats at a dose of 10 mg/kg(1/11) 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL771267

实验名称：Partition coefficient (logP) 来源：ChEMBL 靶标：N/A External Id：CHEMBL643268

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