2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one

更新时间：2025-09-18 10:49:52

2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one结构式	常用名	2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one	英文名	2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one
	CAS号	104715-80-2	分子量	357.40700
	密度	1.34g/cm3	沸点	611.3ºC at 760mmHg
	分子式	C₁₈H₂₃N₅O₃	熔点	N/A
	MSDS	N/A	闪点	323.5ºC

英文名	2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one

密度	1.34g/cm3
沸点	611.3ºC at 760mmHg
分子式	C₁₈H₂₃N₅O₃
分子量	357.40700
闪点	323.5ºC
精确质量	357.18000
PSA	105.32000
LogP	2.65750
InChIKey	FTTOTLVQWYDVIL-UHFFFAOYSA-N
SMILES	CCCCc1ccc(Nc2nc3c(ncn3COCCO)c(=O)[nH]2)cc1
蒸汽压	8.5E-16mmHg at 25°C
折射率	1.647

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104715-76-6

~82%

2-(4-butylanili...

104715-80-2

文献：Wright, George E.; Dudycz, Lech W.; Kazimierczuk, Zygmunt; Brown, Neal C.; Khan, Naseema N. Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 109 - 116

4-正丁基苯胺

104-13-2

2-(4-butylanili...

104715-80-2

文献：Wright, George E.; Dudycz, Lech W.; Kazimierczuk, Zygmunt; Brown, Neal C.; Khan, Naseema N. Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 109 - 116

2-溴次黄嘌呤

87781-93-9

2-(4-butylanili...

104715-80-2

文献：Wright, George E.; Dudycz, Lech W.; Kazimierczuk, Zygmunt; Brown, Neal C.; Khan, Naseema N. Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 109 - 116

实验名称：Effect on DNA synthesis by HeLa cells was determined by the percentage inhibition of ...
来源：ChEMBL
靶标：HeLa
External Id：CHEMBL702659

实验名称：Inhibitory activity against Herpes simplex virus type-I specific thymidine kinase
来源：ChEMBL
靶标：Thymidine kinase
External Id：CHEMBL810049

实验名称：Effect on DNA synthesis by HeLa cells was determined by the percentage inhibition of ...
来源：ChEMBL
靶标：HeLa
External Id：CHEMBL698141

实验名称：HIV Cellular Data
来源：NIAID
靶标：N/A
External Id：HIV Cellular Data

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