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2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione

更新时间:2025-11-29 20:29:44

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式
2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式
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常用名 2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione 英文名 2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione
CAS号 95604-92-5 分子量 365.42900
密度 N/A 沸点 N/A
分子式 C20H23N5O2 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione
英文别名 更多

 物理化学性质

分子式 C20H23N5O2
分子量 365.42900
精确质量 365.18500
PSA 69.64000
LogP 1.61580
InChIKey QFMFYDYACBTMIQ-UHFFFAOYSA-N
SMILES O=C1c2ccccc2C(=O)N1CCCCN1CCN(c2ncccn2)CC1

 合成线路

~82%

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式

2-[4-(4-pyrimid...

95604-92-5

文献:Ishizumi; Kojima; Antoku Chemical and Pharmaceutical Bulletin, 1991 , vol. 39, # 9 p. 2288 - 2300

~96%

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式

2-[4-(4-pyrimid...

95604-92-5

文献:Troponwerke GmbH and Co., KG Patent: US4818756 A1, 1989 ;

~%

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式

2-[4-(4-pyrimid...

95604-92-5

文献:Ishizumi; Kojima; Antoku Chemical and Pharmaceutical Bulletin, 1991 , vol. 39, # 9 p. 2288 - 2300

~%

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式

2-[4-(4-pyrimid...

95604-92-5

文献:Ishizumi; Kojima; Antoku Chemical and Pharmaceutical Bulletin, 1991 , vol. 39, # 9 p. 2288 - 2300

~29%

2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]isoindole-1,3-dione结构式

2-[4-(4-pyrimid...

95604-92-5

文献:Ishizumi; Kojima; Antoku Chemical and Pharmaceutical Bulletin, 1991 , vol. 39, # 9 p. 2288 - 2300

 靶点实验

查看更多实验

实验名称:Binding affinity at Dopamine receptor D2 in rat corpus striatum by displacing [3H]-sp...
来源:ChEMBL
靶标:D(2) dopamine receptor
External Id:CHEMBL667494
实验名称:In vitro binding affinity against 5-hydroxytryptamine 1A receptor using [3H]8-OH-DPAT...
来源:ChEMBL
靶标:5-hydroxytryptamine receptor 1A
External Id:CHEMBL616273
实验名称:Hill coefficient in rat brain 5-hydroxytryptamine 1A assay
来源:ChEMBL
靶标:5-hydroxytryptamine receptor 1A
External Id:CHEMBL841450
实验名称:Maximum effective dose that causes vogel anticonflict effect when given through oral ...
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL786832
实验名称:Binding affinity of a compound to rat brain 5-hydroxytryptamine 1A (serotonin) recept...
来源:ChEMBL
靶标:5-hydroxytryptamine receptor 1A
External Id:CHEMBL616344
实验名称:Effective oral dose that conditioned avoidance response in rat
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL780685
实验名称:CYP3A4 metabolism half-life (t1/2)
来源:ChEMBL
靶标:N/A
External Id:CHEMBL618371
实验名称:Effective oral dose that produce reversal of trifluoperazine-induced catalepsy in rat
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL780686
实验名称:Evaluated for binding affinity towards 5-hydroxytryptamine 1A receptor in rat brain
来源:ChEMBL
靶标:5-hydroxytryptamine receptor 1A
External Id:CHEMBL615962
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 英文别名

1H-Isoindole-1,3(2H)-dione,2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]
2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1H-isoindole-1,3(2H)-dione
2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)isoindole-1,3(2H)dione
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