2-Propenoic acid,2-(benzoylamino)-3-phenyl-, ethyl ester结构式
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常用名 | 2-Propenoic acid,2-(benzoylamino)-3-phenyl-, ethyl ester | 英文名 | 2-Propenoic acid,2-(benzoylamino)-3-phenyl-, ethyl ester |
|---|---|---|---|---|
| CAS号 | 32089-78-4 | 分子量 | 295.33200 | |
| 密度 | 1.174g/cm3 | 沸点 | 506.9ºC at 760mmHg | |
| 分子式 | C18H17NO3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 260.4ºC |
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 | ethyl 2-benzamido-3-phenylprop-2-enoate |
|---|---|
| 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 | 1.174g/cm3 |
|---|---|
| 沸点 | 506.9ºC at 760mmHg |
| 分子式 | C18H17NO3 |
| 分子量 | 295.33200 |
| 闪点 | 260.4ºC |
| 精确质量 | 295.12100 |
| PSA | 55.40000 |
| LogP | 3.41150 |
| InChIKey | VORSPIWDEWUVCK-DTQAZKPQSA-N |
| SMILES | CCOC(=O)C(=Cc1ccccc1)NC(=O)c1ccccc1 |
| 折射率 | 1.601 |
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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2-Propenoic aci... 32089-78-4 |
| 文献:Liu, Bingjie; Zhang, Yueteng; Huang, Gang; Zhang, Xinting; Niu, Pengfei; Wu, Jie; Yu, Wenquan; Chang, Junbiao Organic and Biomolecular Chemistry, 2014 , vol. 12, # 23 p. 3912 - 3923 |
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2-Propenoic aci... 32089-78-4 |
| 文献:Carter; Risser Journal of Biological Chemistry, 1941 , vol. 139, p. 255,260 |
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2-Propenoic aci... 32089-78-4 |
| 文献:Carter; Risser Journal of Biological Chemistry, 1941 , vol. 139, p. 255,260 |
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2-Propenoic aci... 32089-78-4 |
| 文献:Shabana, R.; Sidky, M. M.; El-Kateb, A. A.; Soliman, F. M. Phosphorus and Sulfur and the Related Elements, 1987 , vol. 34, p. 57 - 62 |
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2-Propenoic aci... 32089-78-4 |
| 文献:Erlenmeyer Justus Liebigs Annalen der Chemie, 1893 , vol. 275, p. 11 |
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 6 | |
|---|---|
| 下游产品 1 | |
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:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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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: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-benzoylamino-3,3-bis(p-chlorophenylthio)acrylonitrile |
| N-{2,2-bis[(4-chlorophenyl)sulfanyl]-1-cyanoethenyl}benzamide |
| 2-Benzamino-3-phenyl-acrylsaeure-aethylester |
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: 32089-78-4有哪些英文别名? |
| A: 32089-78-4英文别名有:3-benzoylamino-3,3-bis(p-chlorophenylthio)acrylonitrile、 N-{2,2-bis[(4-chlorophenyl)sulfanyl]-1-cyanoethenyl}benzamide、 2-Benzamino-3-phenyl-acrylsaeure-aethylester。 |
| Q: 32089-78-4的极性表面积PSA是多少? |
| A: 32089-78-4极性表面积PSA为55.40000。 |
| Q: 32089-78-4的CAS号是多少? |
| A: 32089-78-4CAS号为32089-78-4。 |
| Q: 32089-78-4的沸点是多少? |
| A: 32089-78-4沸点为506.9ºC at 760mmHg。 |
| Q: 32089-78-4的SMILES表达式是什么? |
| A: 32089-78-4SMILES表达式为CCOC(=O)C(=Cc1ccccc1)NC(=O)c1ccccc1。 |
| Q: 32089-78-4的LogP(油水分配系数)是多少? |
| A: 32089-78-4LogP(油水分配系数)为3.41150。 |
| Q: 32089-78-4的英文名称是什么? |
| A: 32089-78-4英文名称为ethyl 2-benzamido-3-phenylprop-2-enoate。 |
| Q: 32089-78-4的分子量是多少? |
| A: 32089-78-4分子量为295.33200。 |
| Q: 32089-78-4的上游原料有哪些? |
| A: 32089-78-4相关上游原料(CAS):64-17-5;17606-70-1;26348-47-0;141-52-6;842-74-0;7664-93-9。 |
| Q: 32089-78-4的分子式是什么? |
| A: 32089-78-4分子式为C18H17NO3。 |