5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮

• 常用名: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮
• 英文名: C-1311
• CAS号: 138154-39-9
• 分子量: 350.41400
• 密度: 1.32g/cm3
• 沸点: 605.8ºC at 760mmHg
• 分子式: C₂₀H₂₂N₄O₂
• 熔点: N/A
• 闪点: 320.2ºC
• 符号: GHS07
• 信号词: Warning

用途

Symadex, also known as imidazoacridone; XLS-002 and C-1311, is a member of the novel imidazoacridinone family of anticancer agents. Imidazoacridone has shown activity in experimental tumour models both in vitro and in nude mice. C-1311 at the EC(99) dose delayed progression of cells through the S phase which was followed by G2 arrest. C-1311 does not induce rapid apoptosis in HT-29 cells, instead drug exposure leads to prolonged G2 arrest followed by G2 to M transit and cell death during mitosis in the process of mitotic catastrophe.

名称

本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。

• 中文名: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮
• 英文名: 5-((2-(diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo[4,5,1-de]acridin-6-one

物理化学性质

本表包含该物质理化参数，如熔点、沸点、密度、溶解度、旋光性等理化指标，无数据项标记为N/A。

• 密度: 1.32g/cm3
• 沸点: 605.8ºC at 760mmHg
• 分子式: C₂₀H₂₂N₄O₂
• 分子量: 350.41400
• 闪点: 320.2ºC
• 精确质量: 350.17400
• PSA: 69.87000
• LogP: 2.97100
• InChIKey: CUNDRHORZHFPLY-UHFFFAOYSA-N
• SMILES: CCN(CC)CCNc1ccc2ncn3c4ccc(O)cc4c(=O)c1c23
• 蒸汽压: 2.86E-15mmHg at 25°C
• 折射率: 1.68

安全信息

本表记录该化合物安全警示、防护措施、禁配物、处置方式等安全相关参考信息。

• 符号: GHS07
• 信号词: Warning
• 危害声明: H302
• 危险品运输编码: NONH for all modes of transport

靶点实验

查看更多实验

本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。

实验名称：Antineoplastic activity was evaluated in vivo against murine leukemia P388 (i.p./i.p.... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL744875

实验名称：Antiproliferative activity against human SW480 cells assessed as reduction in cell vi... 来源：ChEMBL 靶标：SW480 External Id：CHEMBL4677484

实验名称：Antiproliferative activity against human HCT-116 cells assessed as reduction in cell ... 来源：ChEMBL 靶标：HCT-116 External Id：CHEMBL4677483

实验名称：Antitumor activity against Mus musculus (mouse) P388 cells xenografted in Mus musculu... 来源：ChEMBL 靶标：P388 External Id：CHEMBL3052671

实验名称：Drug metabolism in human duodenum microsomes assessed as glucuronidation activity at ... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3533983

实验名称：Drug metabolism in human jejunum microsomes assessed as glucuronidation activity at 0... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3533984

实验名称：Drug metabolism in human liver microsomes assessed as metabolite formation treated wi... 来源：ChEMBL 靶标：Liver microsome External Id：CHEMBL3531981

实验名称：Drug metabolism in human colon microsomes assessed as glucuronidation activity at 0.1... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3533987

实验名称：Cytotoxicity against human HCT116 cells after 24 hrs by MTT assay 来源：ChEMBL 靶标：HCT-116 External Id：CHEMBL1837964

实验名称：Inhibition of human recombinant NQO2 assessed as reduction of DCPIP by spectrophotome... 来源：ChEMBL 靶标：Ribosyldihydronicotinamide dehydrogenase [quinone] External Id：CHEMBL1837963

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英文别名

本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。

• 5-[[(diethylamino)ethyl]amino]-8-hydroxyimidazo[4,5,1-de]-acridine-6-one
• C 1311
• XLS-002
• 6H-Imidazo(4,5,1-de)acridin-6-one,5-((2-(diethylamino)ethyl)amino)-8-hydroxy
• 5-((2-(Diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo(4,5,1-de)acridin-6-one

常见问题

本部分为该化合物相关常见问答，包含基础参数、性状、储存条件等高频咨询问题与对应答案。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的极性表面积PSA是多少？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮极性表面积PSA为69.87000。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的SMILES表达式是什么？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮SMILES表达式为CCN(CC)CCNc1ccc2ncn3c4ccc(O)cc4c(=O)c1c23。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的InChIKey是什么？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮InChIKey为CUNDRHORZHFPLY-UHFFFAOYSA-N。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮有哪些英文别名？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮英文别名有：5-[[(diethylamino)ethyl]amino]-8-hydroxyimidazo[4,5,1-de]-acridine-6-one、 C 1311、 XLS-002、 6H-Imidazo(4,5,1-de)acridin-6-one,5-((2-(diethylamino)ethyl)amino)-8-hydroxy、 5-((2-(Diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo(4,5,1-de)acridin-6-one。

Q: 138154-39-9的中文名称是什么？

A: 138154-39-9的中文名称为5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的LogP（油水分配系数）是多少？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮LogP（油水分配系数）为2.97100。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的分子式是什么？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮分子式为C20H22N4O2。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的分子量是多少？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮分子量为350.41400。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的英文名称是什么？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮英文名称为5-((2-(diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo[4,5,1-de]acridin-6-one。

Q: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮的CAS号是多少？

A: 5-((2-(二乙基氨基)乙基)氨基)-8-羟基-6H-咪唑并[4,5,1-de]吖啶-6-酮CAS号为138154-39-9。