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273-40-5 ((9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶,1H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI))

结构式：

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶结构式图片|273-40-5结构式图片

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶MOL文件

CAS号：

273-40-5

中文名称：

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶

英文名称：

1H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI)

分子式：

C₄H₃N₅

分子量：

121.100118875504

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶(273-40-5)名称与标识符

名称

中文别名：

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶;

英文别名：

1H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI);3H-1,2,3-Triazolo[4,5-d]pyrimidine;3H-[1,2,3]Triazolo[4,5-d]pyrimidine;2H-triazolo[4, 5-d]pyrimidine;1,2,3,4,6-PENTAAZAINDENE;3H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI);99331-25-6;179192-35-9;8-Azapurine;GIIGHSIIKVOWKZ-UHFFFAOYSA-N;3H-1,2,3-TRIAZOLO(4,5-D)PYRIMIDINE;4H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE;EN300-6746028;H49B4KW3PH;DTXSID80181745;SCHEMBL26606;4H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI);UNII-H49B4KW3PH;1H-1,2,3-Triazolo(4,5-d)pyrimidine;179268-22-5;179268-21-4;6H-1,2,3-Triazolo[4,5-d]pyrimidine (9CI);273-40-5;2H-triazolo[4,5-d]pyrimidine;SCHEMBL11026556;AKOS006372727;1h-[1,2,3]triazolo[4,5-d]pyrimidine;

标识符

InChIKey：

GIIGHSIIKVOWKZ-UHFFFAOYSA-N

Inchi：

1S/C4H3N5/c1-3-4(6-2-5-1)8-9-7-3/h1-2H,(H,5,6,7,8,9)

SMILES：

N1=C2C=NC=NC2=NN1

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶(273-40-5)物化性质

实验特性

PSA : 67.35

计算特性

精确分子量 : 121.03899
氢键供体数量 : 1
氢键受体数量 : 5
可旋转化学键数量 : 0
同位素质量 : 121.03884512g/mol
重原子数量 : 9
复杂度 : 105
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : -0.4
拓扑分子极性表面积 : 67.4Å²

(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶(273-40-5)相关文献

1. The first example of palladium-catalyzed cascade amidine arylation–intramolecular ester amidation for the synthesis of hypoxanthines: application to the synthesis of 8-azanebularine analogues
Wu Yang,Haoran Ma,Qian Yang,Jingwen Wang,Yuan Liu,Qinghua Yang,Jie Wu,Chuanjun Song,Junbiao Chang Org. Biomol. Chem. 2017 15 379
2. Photophysics, photochemistry and bioimaging application of 8-azapurine derivatives
Alexander K. Eltyshev,Irina A. Agafonova,Artem S. Minin,Varvara A. Pozdina,Vadim A. Shevirin,Pavel A. Slepukhin,Enrico Benassi,Nataliya P. Belskaya Org. Biomol. Chem. 2021 19 9880
3. Heterocyclisation of trisubstituted formamidines containing an aryl or hetaryl substituent at the imine nitrogen atom
Gennady V. Oshovsky,Alexander M. Pinchuk Russ. Chem. Rev. 2000 69 845
4. Mono-N-oxidation of heterocycle-fused pyrimidines
Yongxing Tang,Kejia Li,Ajay Kumar Chinnam,Richard J. Staples,Jean'ne M. Shreeve Dalton Trans. 2021 50 2143
5. A multiresidue analytical method for the detection of seven triazolopyrimidine sulfonamide herbicides in cereals, soybean and soil using the modified QuEChERS method and UHPLC-MS/MS
Jun Xu,Jingge Zhang,Fengshou Dong,Xingang Liu,Guangyan Zhu,Yongquan Zheng Anal. Methods 2015 7 9791
6. Nanoencapsulation of a ruthenium(ii) complex with triazolopyrimidine in liposomes as a tool for improving its anticancer activity against melanoma cell lines
Marzena Fandzloch,Anna Jaromin,Magdalena Zaremba-Czogalla,Andrzej Wojtczak,Agnieszka Lewińska,Jerzy Sitkowski,Joanna Wi?niewska,Iwona ?akomska,Jerzy Gubernator Dalton Trans. 2020 49 1207
7. New organometallic ruthenium(ii) complexes with purine analogs – a wide perspective on their biological application
Marzena Fandzloch,Tomasz J?drzejewski,Liliana Dobrzańska,Ginés M. Esteban-Parra,Joanna Wi?niewska,Agata Paneth,Piotr Paneth,Jerzy Sitkowski Dalton Trans. 2021 50 5557
8. Syntheses and magnetic properties of a bis-bidentate nitronyl nitroxide radical based on triazolopyrimidine and its metal complexes
Cheng-Cai Xia,Xin-Yu Zhang,Cheng-Cheng Zhang,Gang Li,Hai-Yan Wei,Xin-Yi Wang Dalton Trans. 2023 52 8964
9. Mono- and dinuclear platinum(II) compounds with 5,7-dimethyl-1,2,4-triazolo[1,5-a]pyrimidine. Structure, cytotoxic activity and reaction with 5′-GMP
Iwona ?akomska,Huub Kooijman,Anthony L. Spek,Wei-Zheng Shen,Jan Reedijk Dalton Trans. 2009 10736
10. Dicarboxylato platinum(ii) complexes containing dimethyl sulfoxide and triazolopyrimidine as potential anticancer agents: synthesis, structural and biological studies in solution
Mateusz Jakubowski,Iwona ?akomska,Jerzy Sitkowski,Joanna Wi?niewska New J. Chem. 2018 42 8113

目录

相关化合物

500338-80-7(5,7-二氯-1H-[1,2,3]三唑[4,5-d]嘧啶) 6133-70-6((9ci)-嘧啶并[4,5-e]-1,2,3,4-四嗪) 78784-70-0(3-CHLORO-6-(2-PYRIDINYLMETHYL)PYRIDAZINE) 78789-65-8(butyl 3-(trichlorostannyl)propanoate compound with 2,2'-bipyridine (1:1) (en)) 792913-82-7((8-甲基-1,4-二氧杂螺[4.5]癸烷-8-基)氨基甲酸叔丁酯) 79324-78-0(1-(3-溴-4-(甲基硫代)苯基)乙酮) 78861-31-1(1,4-丁二醇，1-（4-甲基苯基）-) 78930-16-2(4-羟基-4-苯氧基苯甲酮)

问答

960化工网为您提供(9ci)-1H-1,2,3-噻唑并[4,5-d]嘧啶专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.273-40-5,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:273-40-5 国际站:273-40-5

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