3-(4-nitrophenyl)-1-oxa-2,4-diaza-3-azoniacyclopent-3-en-5-one结构式
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常用名 | 3-(4-nitrophenyl)-1-oxa-2,4-diaza-3-azoniacyclopent-3-en-5-one | 英文名 | 3-(4-nitrophenyl)-1-oxa-2,4-diaza-3-azoniacyclopent-3-en-5-one |
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| CAS号 | 80862-32-4 | 分子量 | 209.13900 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C7H5N4O4+ | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | 3-(4-nitrophenyl)-2H-oxatriazol-3-ium-5-one |
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| 英文别名 | 更多 |
| 分子式 | C7H5N4O4+ |
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| 分子量 | 209.13900 |
| 精确质量 | 209.03100 |
| PSA | 108.59000 |
| LogP | 0.07100 |
| InChIKey | NSGMWYNFZUDTDC-UHFFFAOYSA-O |
| SMILES | O=c1[nH][n+](-c2ccc([N+](=O)[O-])cc2)no1 |
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~93%
3-(4-nitropheny... 80862-32-4 |
| 文献:Shevelev; Dalinger; Gulevskaya; Cherkasova; Vinogradov; Ugrak; Starosotnikov Chemistry of Heterocyclic Compounds, 1999 , vol. 35, # 3 p. 363 - 373 |
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~37%
3-(4-nitropheny... 80862-32-4 |
| 文献:Martynova, M. N.; Pevzner, M. S.; Smorygo, N. A.; Serebryakova, N. M. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1981 , vol. 17, # 12 p. 1238 - 1240 Khimiya Geterotsiklicheskikh Soedinenii, 1981 , vol. 17, # 12 p. 1682 - 1684 |
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~%
3-(4-nitropheny... 80862-32-4 |
| 文献:Lund, Mary Q.; Kier, Lemont B.; Glennon, Richard A.; Egle, John L. Journal of Medicinal Chemistry, 1982 , vol. 25, # 12 p. 1503 - 1505 |
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~0%
3-(4-nitropheny... 80862-32-4 |
| 文献:Martynova, M. N.; Pevzner, M. S.; Smorygo, N. A.; Serebryakova, N. M. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1981 , vol. 17, # 12 p. 1238 - 1240 Khimiya Geterotsiklicheskikh Soedinenii, 1981 , vol. 17, # 12 p. 1682 - 1684 |
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~%
3-(4-nitropheny... 80862-32-4 |
| 文献:Huenig; Boes Justus Liebigs Annalen der Chemie, 1953 , vol. 579, p. 28,42, 43 |
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实验名称:NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
来源:DTP/NCI
靶标:N/A
External Id:MCF7_OneDose
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实验名称:NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
来源:DTP/NCI
靶标:N/A
External Id:IGROV1_OneDose
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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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| 3-<4-Nitro-phenyl>-1.2.3.4-oxatriazolon |