4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one结构式
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常用名 | 4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one | 英文名 | 4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one |
|---|---|---|---|---|
| CAS号 | 102750-04-9 | 分子量 | 386.44300 | |
| 密度 | 1.251g/cm3 | 沸点 | 575.2ºC at 760mmHg | |
| 分子式 | C24H22N2O3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 301.7ºC |
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。
| 英文名 | 4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one |
|---|---|
| 英文别名 | 更多 |
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 | 1.251g/cm3 |
|---|---|
| 沸点 | 575.2ºC at 760mmHg |
| 分子式 | C24H22N2O3 |
| 分子量 | 386.44300 |
| 闪点 | 301.7ºC |
| 精确质量 | 386.16300 |
| PSA | 50.80000 |
| LogP | 4.92570 |
| InChIKey | INKUVBMAPRSNKE-UHFFFAOYSA-N |
| SMILES | COc1ccc(NC2=CC(c3ccccc3)N(c3ccc(OC)cc3)C2=O)cc1 |
| 蒸汽压 | 3.11E-13mmHg at 25°C |
| 折射率 | 1.654 |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~95%
4-(4-methoxyani... 102750-04-9 |
| 文献:Qian, Jin-Long; Yi, Wen-Bin; Cai, Chun Tetrahedron Letters, 2013 , vol. 54, # 52 p. 7100 - 7102 |
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~92%
4-(4-methoxyani... 102750-04-9 |
| 文献:Shaterian, Hamid Reza; Ranjbar, Mohammad Research on Chemical Intermediates, 2014 , vol. 40, # 5 p. 2059 - 2074 |
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~91%
4-(4-methoxyani... 102750-04-9 |
| 文献:Wu, Yan-Chao; Liu, Li; Wang, Dong; Chen, Yong-Jun Journal of Heterocyclic Chemistry, 2006 , vol. 43, # 4 p. 949 - 955 |
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~%
4-(4-methoxyani... 102750-04-9 |
| 文献:Ghashang, Majid Research on Chemical Intermediates, 2013 , vol. 39, # 5 p. 2187 - 2195 |
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~%
4-(4-methoxyani... 102750-04-9 |
| 文献:Ghashang, Majid Research on Chemical Intermediates, 2013 , vol. 39, # 5 p. 2187 - 2195 |
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~%
4-(4-methoxyani... 102750-04-9 |
| 文献:Bodforss Justus Liebigs Annalen der Chemie, 1927 , vol. 455, p. 60 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| 上游产品 7 | |
|---|---|
| 下游产品 0 | |
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。
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:qHTS for Inhibitors of Plasmodium falciparum (CP250) proliferation
来源:NCGC
靶标:N/A
External Id:bumalcp250
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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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。
| 3-(4-methoxyphenylamino)-1-(4-methoxyphenyl)-5-phenyl-1H-pyrrol-2(5H)-one |
| 3-p-Anisidino-5-phenyl-1-(4-methoxy-phenyl)-5H-pyrrolon-(2) |
| 3-p-Anisidino-1-(4-methoxy-phenyl)-5-phenyl-1,5-dihydro-pyrrol-2-on |
| 3-p-anisidino-1-(4-methoxy-phenyl)-5-phenyl-1,5-dihydro-pyrrol-2-one |
| 1-(4-methoxyphenyl)-3-((4-methoxyphenyl)amino)-5-phenyl-1H-pyrrol-2(5H)-one |
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: 102750-04-9的分子式是什么? |
| A: 102750-04-9分子式为C24H22N2O3。 |
| Q: 102750-04-9的CAS号是多少? |
| A: 102750-04-9CAS号为102750-04-9。 |
| Q: 102750-04-9的LogP(油水分配系数)是多少? |
| A: 102750-04-9LogP(油水分配系数)为4.92570。 |
| Q: 102750-04-9的分子量是多少? |
| A: 102750-04-9分子量为386.44300。 |
| Q: 102750-04-9的中文名称是什么? |
| A: 102750-04-9的中文名称为102750-04-9。 |
| Q: 102750-04-9的英文名称是什么? |
| A: 102750-04-9英文名称为4-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-phenyl-2H-pyrrol-5-one。 |
| Q: 102750-04-9的上游原料有哪些? |
| A: 102750-04-9相关上游原料(CAS):600-22-6;100-52-7;104-94-9;617-35-6;107969-78-8;783-08-4;127-17-3。 |
| Q: 102750-04-9的InChIKey是什么? |
| A: 102750-04-9InChIKey为INKUVBMAPRSNKE-UHFFFAOYSA-N。 |
| Q: 102750-04-9的沸点是多少? |
| A: 102750-04-9沸点为575.2ºC at 760mmHg。 |
| Q: 102750-04-9的SMILES表达式是什么? |
| A: 102750-04-9SMILES表达式为COc1ccc(NC2=CC(c3ccccc3)N(c3ccc(OC)cc3)C2=O)cc1。 |