1,3-二甲基-1H-吡咯并[3,2-d]嘧啶-2,4(3H,5H)-二酮

更新时间：2025-08-26 11:29:00

1,3-二甲基-1H-吡咯并[3,2-d]嘧啶-2,4(3H,5H)-二酮结构式	常用名	1,3-二甲基-1H-吡咯并[3,2-d]嘧啶-2,4(3H,5H)-二酮	英文名	1,3-Dimethyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
	CAS号	46155-89-9	分子量	179.17600
	密度	1.381g/cm3	沸点	369.6ºC at 760 mmHg
	分子式	C₈H₉N₃O₂	熔点	N/A
	MSDS	N/A	闪点	177.3ºC

中文名	1,3-二甲基-1H-吡咯并[3,2-d]嘧啶-2,4(3H,5H)-二酮
英文名	1,3-Dimethyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
英文别名	更多

密度	1.381g/cm3
沸点	369.6ºC at 760 mmHg
分子式	C₈H₉N₃O₂
分子量	179.17600
闪点	177.3ºC
精确质量	179.06900
PSA	59.79000
InChIKey	XLSXPKZIKMPZHK-UHFFFAOYSA-N
SMILES	Cn1c(=O)c2[nH]ccc2n(C)c1=O
折射率	1.611
储存条件	室温，干燥密封

毒性英文版

海关编码	2933990090

1,3-dimethyl-6-...

55276-27-2

~35%

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文献：Grahner; Winiwarter; Lanzner; Muller Journal of Medicinal Chemistry, 1994 , vol. 37, # 10 p. 1526 - 1534

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文献：Tkachenko; Tsupak; Pozharskii Chemistry of Heterocyclic Compounds, 2000 , vol. 36, # 3 p. 307 - 310

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文献：Grahner; Winiwarter; Lanzner; Muller Journal of Medicinal Chemistry, 1994 , vol. 37, # 10 p. 1526 - 1534

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文献：Abdou, Wafaa M.; Fahmy, Amin F. M.; Kamel, Azza A. Heteroatom Chemistry, 2002 , vol. 13, # 4 p. 357 - 365

3,6-dimethyl-1H...

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文献：Grahner; Winiwarter; Lanzner; Muller Journal of Medicinal Chemistry, 1994 , vol. 37, # 10 p. 1526 - 1534

1,3-dimethyl-6-...

116705-30-7

~64%

1,3-二甲基-1H-吡咯并[...

46155-89-9

文献：Tsupak, E. B.; Tkachenko, Yu. N.; Pozharskii, A. F. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1994 , vol. 30, # 9 p. 1077 - 1082 Khimiya Geterotsiklicheskikh Soedinenii, 1994 , # 9 p. 1242 - 1248

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303768-04-9

1,3-二甲基-1H-吡咯并[...

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文献：Baraldi, Pier Giovanni; Romagnoli, Romeo; Saponaro, Giulia; Aghazadeh Tabrizi, Mojgan; Baraldi, Stefania; Pedretti, Pamela; Fusi, Camilla; Nassini, Romina; Materazzi, Serena; Geppetti, Pierangelo; Preti, Delia Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 5 p. 1690 - 1698

上游产品 6
CAS号55276-27-2 1,3-dimethyl-6-... CAS号55326-07-3 1,3,6-trimethyl... CAS号13509-52-9 1,3,6-三甲基嘧啶-2,4... CAS号61541-41-1 6-azido-1,3-dim...
CAS号1560-54-9 烯丙基三苯基溴化膦 CAS号19674-60-3 3,6-dimethyl-1H...
下游产品 0

海关编码	2933990090
中文概述	2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素	品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

实验名称：Binding affinity to A1 adenosine receptor from rat cortical membrane in presence of [...
来源：ChEMBL
靶标：Adenosine receptor A1
External Id：CHEMBL637899

实验名称：Binding affinity to A2 adenosine receptor from rat striatal membrane in presence of [...
来源：ChEMBL
靶标：Adenosine receptor A2a
External Id：CHEMBL645451

实验名称：A1 selectivity is the ratio between A2 and A1 receptor
来源：ChEMBL
靶标：Adenosine receptors; A1 & A2
External Id：CHEMBL840516

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1,3-dimethyl-5H-pyrrolo[3,2-d]pyrimidine-2,4-dione