4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanenitrile

• 常用名: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanenitrile
• 英文名: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanenitrile
• CAS号: 88338-88-9
• 分子量: 247.25300
• 密度: 1.37g/cm3
• 沸点: 532.2ºC at 760 mmHg
• 分子式: C₁₁H₁₃N₅O₂
• 熔点: N/A
• 闪点: 275.7ºC

名称

• 英文名: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)butanenitrile

物理化学性质

• 密度: 1.37g/cm3
• 沸点: 532.2ºC at 760 mmHg
• 分子式: C₁₁H₁₃N₅O₂
• 分子量: 247.25300
• 闪点: 275.7ºC
• 精确质量: 247.10700
• PSA: 85.61000
• InChIKey: DJAXYTCEYBZGKN-UHFFFAOYSA-N
• SMILES: Cn1c(=O)c2c(ncn2CCCC#N)n(C)c1=O
• 折射率: 1.66

靶点实验

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实验名称：Antimicrobial activity against Candida albicans MTCC 10145 incubated overnight by two... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL3870594

实验名称：Antimicrobial activity against Staphylococcus aureus ATCC 25923 incubated overnight b... 来源：ChEMBL 靶标：Staphylococcus aureus External Id：CHEMBL3870590

实验名称：Antimicrobial activity against Bacillus cereus ATCC 10876 incubated overnight by two-... 来源：ChEMBL 靶标：Bacillus cereus External Id：CHEMBL3870591

实验名称：Antimicrobial activity against Escherichia coli ATCC 25922 incubated overnight by two... 来源：ChEMBL 靶标：Escherichia coli External Id：CHEMBL3870592

实验名称：Antimicrobial activity against Pseudomonas aeruginosa ATCC 10145 incubated overnight ... 来源：ChEMBL 靶标：Pseudomonas aeruginosa External Id：CHEMBL3870593

实验名称：Cytotoxicity against human A549 cells after 48 hrs by MTT assay 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL3870586

实验名称：Cell-based high throughput primary assay to identify activators of GPR151 来源：The Scripps Research Institute Molecular Screening Center 靶标：RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL External Id：GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

实验名称：AlphaScreen-based biochemical high throughput primary assay to identify activators of... 来源：The Scripps Research Institute Molecular Screening Center 靶标：N/A External Id：FBW7_ACT_ALPHA_1536_1X%ACT PRUN

实验名称：AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of... 来源：The Scripps Research Institute Molecular Screening Center External Id：MITF_INH_Alpha_1536_1X%INH PRUN

实验名称：Cytotoxicity against human HT-29 cells after 48 hrs by MTT assay 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL3870587

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英文别名

• 7H-Purine-7-butanenitrile,1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo
• 1,3-Dimethyl-1,2,3,6-tetrahydro-2,6-dioxo-7H-purine-7-butanenitrile
• 7-Cyanopropyltheophylline
• 4-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)butanenitrile