N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide结构式
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常用名 | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide | 英文名 | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide |
|---|---|---|---|---|
| CAS号 | 59903-01-4 | 分子量 | 382.41000 | |
| 密度 | 1.256g/cm3 | 沸点 | 612.1ºC at 760 mmHg | |
| 分子式 | C21H22N2O5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 324ºC |
摘要:N-[2-(3,4-二甲氧基苯基)乙基]-3-(1,3-二氧杂异吲哚-2-基)丙酰胺(英文名:N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide,CAS号:59903-01-4,分子式:C21H22N2O5,分子量:382.41)仅供科研实验参考,不作为医疗诊断与用药依据。
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 | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide |
|---|---|
| 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 | 1.256g/cm3 |
|---|---|
| 沸点 | 612.1ºC at 760 mmHg |
| 分子式 | C21H22N2O5 |
| 分子量 | 382.41000 |
| 闪点 | 324ºC |
| 精确质量 | 382.15300 |
| PSA | 84.94000 |
| LogP | 2.37760 |
| InChIKey | OMGHIHUPCLYGIL-UHFFFAOYSA-N |
| SMILES | COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3C2=O)cc1OC |
| 折射率 | 1.587 |
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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~87%
N-[2-(3,4-dimet... 59903-01-4 |
| 文献:Hocquaux; Viel; Brunaud; et al. European Journal of Medicinal Chemistry, 1983 , vol. 18, # 4 p. 331 - 338 |
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 2 | |
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| 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: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:Primary cell-based high-throughput screening for identification of compounds that all...
来源:Johns Hopkins Ion Channel Center
靶标:MAS-related GPR member X1 [Homo sapiens]
External Id:JHICC_MrgX1_AlloAgonist_Primary
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实验名称:Primary cell-based high-throughput screening for identification of compounds that ant...
来源:Johns Hopkins Ion Channel Center
靶标:MAS-related GPR member X1 [Homo sapiens]
External Id:JHICC_MrgX1_Antagonist_Primary
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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:High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1149-MLP
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实验名称:uHTS identification of small molecule inhibitors of tim10-1 yeast via a luminescent a...
来源:Burnham Center for Chemical Genomics
靶标:TPA: Essential protein of the mitochondrial intermembrane space, forms a complex with Tim9p (TIM10 complex) that delivers hydrophobic proteins to the TIM22 complex for insertion into the inner membrane [Saccharomyces cerevisiae S288c]
External Id:SBCCG-A413-tim10-1-Primary-Antagonist-Assay
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实验名称:384-well Z-Lyte format Hck-Nef inhibitor HTS run at the PMLSC
来源:University of Pittsburgh Molecular Library Screening Center
靶标:N/A
External Id:MH083223 Targeting HIV-1 Nef with Small Molecules
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实验名称:uHTS identification of APOBEC3A DNA Deaminase Inhibitors via a fluorescence-based sin...
来源:Burnham Center for Chemical Genomics
靶标:probable DNA dC->dU-editing enzyme APOBEC-3A [Homo sapiens]
External Id:SBCCG-A539-APOBEC3A-Inhibitor-Primary-Assay
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实验名称:High Throughput Screen to Identify Inhibitors Targeting HIV-1 Vif-dependent Degradati...
来源:Southern Research Institute
靶标:HIV-1 Vif
External Id:HIV1-VIF_MS
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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。
| phtalimidopropionylhomoveratrylamine |
| N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide |
| N-[2-(3,4-Dimethoxy-phenethyl-carbamoyl)-ethyl]-phthalimid |
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: 59903-01-4的中文名称是什么? |
| A: 59903-01-4的中文名称为59903-01-4。 |
| Q: 59903-01-4的LogP(油水分配系数)是多少? |
| A: 59903-01-4LogP(油水分配系数)为2.37760。 |
| Q: 59903-01-4的CAS号是多少? |
| A: 59903-01-4CAS号为59903-01-4。 |
| Q: 59903-01-4的下游产品有哪些? |
| A: 59903-01-4相关下游产品(CAS):59903-02-5。 |
| Q: 59903-01-4的SMILES表达式是什么? |
| A: 59903-01-4SMILES表达式为COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3C2=O)cc1OC。 |
| Q: 59903-01-4的上游原料有哪些? |
| A: 59903-01-4相关上游原料(CAS):24839-50-7;1074-82-4。 |
| Q: 59903-01-4的极性表面积PSA是多少? |
| A: 59903-01-4极性表面积PSA为84.94000。 |
| Q: 59903-01-4的英文名称是什么? |
| A: 59903-01-4英文名称为N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxoisoindol-2-yl)propanamide。 |
| Q: 59903-01-4有哪些英文别名? |
| A: 59903-01-4英文别名有:phtalimidopropionylhomoveratrylamine、 N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide、 N-[2-(3,4-Dimethoxy-phenethyl-carbamoyl)-ethyl]-phthalimid。 |
| Q: 59903-01-4的分子式是什么? |
| A: 59903-01-4分子式为C21H22N2O5。 |