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3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide

更新时间:2025-08-28 07:39:30

3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide结构式
3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide结构式
委托求购
常用名 3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide 英文名 3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide
CAS号 886046-46-4 分子量 668.69200
密度 N/A 沸点 N/A
分子式 C39H45IN2 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 3-Butyl-2-[(1E,3E)-3-(3-butyl-1,1-dimethyl-1,3-dihydro-2H-benzo[e ]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benzo[e]indolium iodide
英文别名 更多

 物理化学性质

分子式 C39H45IN2
分子量 668.69200
精确质量 668.26300
PSA 6.25000
LogP 7.23510
InChIKey HWWGFJINQTYLLX-UHFFFAOYSA-M
SMILES CCCCN1C(=CC=CC2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21.[I-]

 合成线路

~64%

3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide结构式

3-Butyl-2-[3-(3...

886046-46-4

文献:Sinha, Sarmistha Halder; Owens, Eric A.; Feng, You; Yang, Yutao; Xie, Yan; Tu, Yaping; Henary, Maged; Zheng, Yujun George European Journal of Medicinal Chemistry, 2012 , vol. 54, p. 647 - 659

~%

3-Butyl-2-[3-(3-butyl-1,3-dihydro-1,1-dimethyl-2H-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1-dimethyl-1H-benz[e]indolium iodide结构式

3-Butyl-2-[3-(3...

886046-46-4

文献:Sinha, Sarmistha Halder; Owens, Eric A.; Feng, You; Yang, Yutao; Xie, Yan; Tu, Yaping; Henary, Maged; Zheng, Yujun George European Journal of Medicinal Chemistry, 2012 , vol. 54, p. 647 - 659

 靶点实验

查看更多实验

实验名称:Inhibition of His-tagged PRMT1 expressed in Escherichia coli BL21(DE3) cells using [1...
来源:ChEMBL
靶标:Protein arginine N-methyltransferase 1
External Id:CHEMBL2050325
实验名称:Displacement of [3H]-SAM from recombinant His6-tagged PRMT1 (unknown origin) expresse...
来源:ChEMBL
靶标:Protein arginine N-methyltransferase 1
External Id:CHEMBL3411808
实验名称:Displacement of [3H]-SAM from recombinant His6-tagged PRMT1 (unknown origin) expresse...
来源:ChEMBL
靶标:Protein arginine N-methyltransferase 1
External Id:CHEMBL3411805
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 英文别名

2(1H)-Quinolinone,3-butyl-3,4-dihydro-1-(4-methylphenyl)
3-butyl-2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-en-1-yl)-1,1-dimethyl-1H-benzo[e]indol-3-ium iodide
3-butyl-1-p-tolyl-3,4-dihydro-1H-quinolin-2-one
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