3-[3-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-5-nitro-imidazol-4-yl ]sulfanylpropanenitrile结构式
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常用名 | 3-[3-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-5-nitro-imidazol-4-yl ]sulfanylpropanenitrile | 英文名 | 3-[3-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-5-nitro-imidazol-4-yl ]sulfanylpropanenitrile |
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| CAS号 | 110579-04-9 | 分子量 | 377.37500 | |
| 密度 | 1.45g/cm3 | 沸点 | 645.1ºC at 760mmHg | |
| 分子式 | C15H15N5O5S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 343.9ºC |
| 英文名 | 3-[3-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-5-nitroimidazol-4-yl]sulfanylpropanenitrile |
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| 英文别名 | 更多 |
| 密度 | 1.45g/cm3 |
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| 沸点 | 645.1ºC at 760mmHg |
| 分子式 | C15H15N5O5S |
| 分子量 | 377.37500 |
| 闪点 | 343.9ºC |
| 精确质量 | 377.07900 |
| PSA | 167.78000 |
| LogP | 4.11698 |
| InChIKey | UPFKFKSSGOXYDM-UHFFFAOYSA-N |
| SMILES | COc1ccc(Cn2c(C)nc([N+](=O)[O-])c2SCCC#N)cc1[N+](=O)[O-] |
| 蒸汽压 | 1.57E-16mmHg at 25°C |
| 折射率 | 1.659 |
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~86%
3-[3-[(4-methox... 110579-04-9 |
| 文献:Iradyan, M. A.; Ayvazyan, A. Kh.; Mirzoyan, V. S.; Paronikyan, G. M.; Sarkisyan, T. P.; et al. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 6 p. 403 - 408 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 6 p. 667 - 672 |
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实验名称:Small-molecule inhibitors of ST2 (IL1RL1)
来源:20881
靶标:interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id:ST2_IL33_Inhibitors_Primary_Screening_77700
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实验名称:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
来源:24983
靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
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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
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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
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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
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| Propanenitrile,3-((1-((4-methoxy-3-nitrophenyl)methyl)-2-methyl-4-nitro-1H-imidazol-5-yl)thio) |
| 3-((1-((4-Methoxy-3-nitrophenyl)methyl)-2-methyl-4-nitro-1H-imidazol-5-yl)thio)propanenitrile |