4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one结构式
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常用名 | 4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one | 英文名 | 4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one |
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| CAS号 | 13835-15-9 | 分子量 | 341.83500 | |
| 密度 | 1.2g/cm3 | 沸点 | 490.9ºC at 760 mmHg | |
| 分子式 | C19H20ClN3O | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 250.7ºC |
| 英文名 | 4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one |
|---|---|
| 英文别名 | 更多 |
| 密度 | 1.2g/cm3 |
|---|---|
| 沸点 | 490.9ºC at 760 mmHg |
| 分子式 | C19H20ClN3O |
| 分子量 | 341.83500 |
| 闪点 | 250.7ºC |
| 精确质量 | 341.12900 |
| PSA | 38.13000 |
| LogP | 3.20230 |
| InChIKey | WRGOSJVRKURGMQ-UHFFFAOYSA-N |
| SMILES | CN(C)CCn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O |
| 蒸汽压 | 8.79E-10mmHg at 25°C |
| 折射率 | 1.61 |
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~56%
4-[(4-chlorophe... 13835-15-9 |
| 文献:Procopiou, Panayiotis A.; Browning, Christopher; Buckley, Jennifer M.; Clark, Kenneth L.; Fechner, Lise; Gore, Paul M.; Hancock, Ashley P.; Hodgson, Simon T.; Holmes, Duncan S.; Kranz, Michael; Looker, Brian E.; Morriss, Karen M. L.; Parton, Daniel L.; Russell, Linda J.; Slack, Robert J.; Sollis, Steven L.; Vile, Sadie; Watts, Clarissa J. Journal of Medicinal Chemistry, 2011 , vol. 54, # 7 p. 2183 - 2195 |
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~%
4-[(4-chlorophe... 13835-15-9 |
| 文献:VEB Deutsches Hydrierwerk Patent: DE1046625 , 1957 ; |
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实验名称:Antagonist activity at human recombinant histamine H3 receptor expressed in CHO cells...
来源:ChEMBL
靶标:Histamine H3 receptor
External Id:CHEMBL1769656
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实验名称:Antagonist activity at human recombinant histamine H1 receptor expressed in intact CH...
来源:ChEMBL
靶标:Histamine H1 receptor
External Id:CHEMBL1769655
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实验名称:Binding affinity to human adrenergic Alpha-1B receptor expressed in rat intact fibrob...
来源:ChEMBL
靶标:Alpha-1B adrenergic receptor
External Id:CHEMBL1769658
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实验名称:Binding affinity to human adrenergic alpha1A receptor expressed in rat intact fibrobl...
来源:ChEMBL
靶标:Alpha-1A adrenergic receptor
External Id:CHEMBL1769657
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| hl 2197 |