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2,4-Diamino-6-(hydroxymethyl)pteridine - 95%, high purity , CAS No.945-24-4
Basic Description
Synonyms
UNII-1RU16O4RO0 | 4,6-Diamino-1,3,5-triazin-2(1H)-one | Benzo[d][1,2,3]triazin-4(3H)-one | SD-096950 | 6-Hydroxymethyl-2,4-pteridinediamine | EC 700-274-8 | AS-63489 | 2,4-Diamino-6-(hydroxymethyl)pteridine | BCP09303 | NSC 253944 | (2,4-Diamino-pteridin-
Specifications & Purity
≥95%
Storage Temp
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pteridines and derivatives
Alternative Parents
Aminopyrimidines and derivatives Pyrazines Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Primary alcohols Organopnictogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pteridine - Aminopyrimidine - Pyrazine - Pyrimidine - Imidolactam - Heteroaromatic compound - Azacycle - Aromatic alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pteridines and derivatives. These are polycyclic aromatic compounds containing a pteridine moiety, which consists of a pyrimidine fused to a pyrazine ring to form pyrimido(4,5-b)pyrazine.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
488184530
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488184530
IUPAC Name
(2,4-diaminopteridin-6-yl)methanol
INCHI
InChI=1S/C7H8N6O/c8-5-4-6(13-7(9)12-5)10-1-3(2-14)11-4/h1,14H,2H2,(H4,8,9,10,12,13)
InChIKey
CYNARAWTVHQHDI-UHFFFAOYSA-N
Smiles
C1=C(N=C2C(=NC(=NC2=N1)N)N)CO
Isomeric SMILES
C1=C(N=C2C(=NC(=NC2=N1)N)N)CO
Molecular Weight
192.18
Reaxy-Rn
183609
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=183609&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Hygroscopic；Light sensitive
Flash Point(°F)
Not applicable
Flash Point(°C)
Not applicable
Molecular Weight
192.180 g/mol
XLogP3
-1.700
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
1
Exact Mass
192.076 Da
Monoisotopic Mass
192.076 Da
Topological Polar Surface Area
124.000 Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
203.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
1.
Xingqi Huang, Lingce Kong, Wenming Chen, Haibo Wang, Jingjing Zhang, Zhimeng Gao, Yi Xin, Wencai Xu, Yanjun Zuo.
(2023)
Catalytic activation of peracetic acid for capsaicin degradation by Co3O4 nanoparticles in-situ anchored carbon-coated MXene nanosheets: Performance and mechanism insight. JOURNAL OF COLLOID AND INTERFACE SCIENCE,
2.
Dai Yongheng, Yuan Huayu, Li Jiang, Su Qi, Yi Qianwen, Zhang Yuntao.
(2023)
Direct Z-scheme P–TiO2/g-C3N4 heterojunction for the photocatalytic degradation of sulfa antibiotics. RSC Advances,
13
(9):
(5957-5969).
3.
Tengfei Xiang, Yanli Zhang, Linjing Cui, Jiaqi Wang, Depeng Chen, Shunli Zheng, Yujie Qiang.
(2023)
Synergistic inhibition of benzotriazole and sodium D-gluconate on steel corrosion in simulated concrete pore solution. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,
661
(130918).
4.
Shichang Chen, Xuhai Fu, Zhijun Jing, Hongzheng Chen.
(2022)
Non-isothermal crystallization kinetics and rheological behaviors of PBT/PET blends: effects of PET property and nano-silica content. DESIGNED MONOMERS AND POLYMERS,
5.
Shengqi Zhang, Qian Yin, Shangwei Zhang, Kyriakos Manoli, Lei Zhang, Xin Yu, Mingbao Feng.
(2022)
Chlorination of methotrexate in water revisited: Deciphering the kinetics, novel reaction mechanisms, and unexpected microbial risks. WATER RESEARCH,
225
(119181).
6.
Luyao Wang, Jiepan Hu, Dongsheng Li, Okwong Oketch Reymick, Xiaoli Tan, Nengguo Tao.
(2022)
Isolation and control of Botrytis cinerea in postharvest green pepper fruit. SCIENTIA HORTICULTURAE,
302
(111159).
7.
Xiao Xiao, Yan Qiao, Zhirui Xu, Tongyue Wu, Yunxue Wu, Zhe Ling, Yun Yan, Jianbin Huang.
(2021)
Enzyme-Responsive Aqueous Two-Phase Systems in a Cationic–Anionic Surfactant Mixture. LANGMUIR,
37
(44):
(13125–13131).
8.
Yu Luo, Lie Ma.
(2020)
Bioprosthetic heart valves with reduced immunogenic residuals using vacuum-assisted decellularization treatment. Biomedical Materials,
15
(6):
(65012).
9.
Hui Li, Lunchao Duan, Hong Wang, Yajun Chen, Fenghe Wang, Shengtian Zhang.
(2020)
Photolysis of sulfadiazine under UV radiation: Effects of the initial sulfadiazine concentration, pH, NO3− and Cd2+. CHEMICAL PHYSICS LETTERS,
739
(136949).
10.
Wu Youyi, Zhou Jingwen, Wang Xuedong, Zhang Zhanen, Gao Shiqian.
(2019)
Ionic Liquid-based Hollow Fiber Liquid–Liquid–Liquid Microextraction Combined with Capillary Electrophoresis for the Determination of Sulfonamides in Aquaculture Waters. JOURNAL OF CHROMATOGRAPHIC SCIENCE,
57
(10):
(950-960).
11.
Yu Luo, Dong Lou, Lie Ma, Changyou Gao.
(2019)
Optimizing detergent concentration and processing time to balance the decellularization efficiency and properties of bioprosthetic heart valves. JOURNAL OF BIOMEDICAL MATERIALS RESEARCH PART A,
107
(10):
(2235-2243).
12.
Xiangfeng Huang, Yi Feng, Cui Hu, Xiaoyu Xiao, Daliang Yu, Xiaoming Zou.
(2016)
Mechanistic model for interpreting the toxic effects of sulfonamides on nitrification. JOURNAL OF HAZARDOUS MATERIALS,
305
(123).
13.
Minqiong Tang, Qing Wang, Ming Jiang, Li Xu, Zhi-Guo Shi, Ting Zhang, Yan Liu.
(2014)
Magnetic solid-phase extraction based on methylcellulose coated-Fe3O4–SiO2–phenyl for HPLC–DAD analysis of sildenafil and its metabolite in biological samples. TALANTA,
130
(427).
14.
Jing Yuan, Ying Gao, Xinzhuo Tian, Wenhao Su, Yuxin Su, Shengli Niu, Xiangying Meng, Tong Jia, Ronghuan Yin, Jianmin Hu.
(2024)
Computational and Experimental Comparison of Molecularly Imprinted Polymers Prepared by Different Functional Monomers—Quantitative Parameters Defined Based on Molecular Dynamics Simulation. MOLECULES,
29
(17):
(4236).
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14 Citations
F2330551