N,N'-二苯甲酰基-1,2-乙二胺结构式
|
常用名 | N,N'-二苯甲酰基-1,2-乙二胺 | 英文名 | Benzamide,N,N'-1,2-ethanediylbis |
|---|---|---|---|---|
| CAS号 | 644-33-7 | 分子量 | 268.31000 | |
| 密度 | 1.161g/cm3 | 沸点 | 581.3ºC at 760mmHg | |
| 分子式 | C16H16N2O2 | 熔点 | 242ºC | |
| MSDS | N/A | 闪点 | 233.3ºC |
| 中文名 | N,N-乙烯基双苯酰胺 |
|---|---|
| 英文名 | N-(2-benzamidoethyl)benzamide |
| 中文别名 | N,N-乙烯双苯甲酰胺 |
| 英文别名 | 更多 |
| 密度 | 1.161g/cm3 |
|---|---|
| 沸点 | 581.3ºC at 760mmHg |
| 熔点 | 242ºC |
| 分子式 | C16H16N2O2 |
| 分子量 | 268.31000 |
| 闪点 | 233.3ºC |
| 精确质量 | 268.12100 |
| PSA | 58.20000 |
| LogP | 2.62820 |
| InChIKey | NWGGAHDZCNJXJA-UHFFFAOYSA-N |
| SMILES | O=C(NCCNC(=O)c1ccccc1)c1ccccc1 |
| 折射率 | 1.587 |
| 储存条件 | 密封储存,储存于阴凉、干燥的库房。 |
| 稳定性 | 常温常压下稳定,避免与不相容材料接触。 与强氧化剂反应。 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):2.2 2.氢键供体数量:2 3.氢键受体数量:2 4.可旋转化学键数量:5 5.互变异构体数量:3 6.拓扑分子极性表面积58.2 7.重原子数量:20 8.表面电荷:0 9.复杂度:286 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
| 更多 | 1. 性状:白色结晶状粉末 2. 密度(g/mL,25℃):未确定 3. 相对蒸汽密度(g/mL,空气=1):未确定 4. 熔点(ºC):240-244 5. 沸点(ºC,常压):未确定 6. 沸点(ºC,30mmHg):未确定 7. 折射率(n20/D):未确定 8. 闪点(ºC):未确定 9. 比旋光度(º):未确定 10. 自燃点或引燃温度(ºC):未确定 11. 蒸气压(kPa,20ºC):未确定 12. 饱和蒸气压(kPa,25ºC):未确定 13. 燃烧热(KJ/mol):未确定 14. 临界温度(ºC):未确定 15. 临界压力(KPa):未确定 16. 油水(辛醇/水)分配系数的对数值:未确定 17. 爆炸上限(%,V/V):未确定 18. 爆炸下限(%,V/V):未确定 19. 溶解性:不溶于水 |
| 安全声明 (欧洲) | S24/25 |
|---|
| N,N'-二苯甲酰基-1,2-乙二胺上游产品 9 | |
|---|---|
| N,N'-二苯甲酰基-1,2-乙二胺下游产品 8 | |
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
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.
|
|
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
|
|
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
|
|
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
|
|
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
|
| N,N'-bisbenzoyl ethane-1,2-diamine |
| MFCD00267629 |
| N,N'-dibenzoyl-1,2-ethylene diamine |
| n,n'-ethane-1,2-diyldibenzamide |
| N1,N2-dibenzylethane-1,2-diamine |
| 1,N,N'-dibenzoyl |
| Benzamide,N'-ethylenebis |
| N,N'-Ethylenebis(benzamide) |
| N,N'-ethylenedibenzamide |
| N,N'-1,2-ethanediylbisbenzamide |
| N,N'-Dibenzoylethylenediamine |
| EINECS 211-414-8 |