Sulfaquinoxaline - ≥98% , CAS No.59-40-5

CAS: 59-40-5 Cat. No.: S1523158 Fórmula: C₁₄H₁₂N₄O₂S Peso molecular: 300.34 Beilstein Registry Number: 290026 Número EC: 200-423-2 PubChem CID: 5338

GRADE & PURITY ≥98%

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N
• IUPAC Name: 4-amino-N-quinoxalin-2-ylbenzenesulfonamide
• InChIKey: NHZLNPMOSADWGC-UHFFFAOYSA-N
• INCHI: 1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)
• Isómeros SMILES: C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N
• PubChem CID: 5338
• Peso molecular: 300.34
• Beilstein: 290026

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinoxalines
• Alternative Parents: Benzenesulfonamides Benzenesulfonyl compounds Aniline and substituted anilines Pyrazines Imidolactams Sulfonyls Organosulfonic acids and derivatives Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzenesulfonamide - Quinoxaline - Benzenesulfonyl group - Aniline or substituted anilines - Monocyclic benzene moiety - Pyrazine - Benzenoid - Imidolactam - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Azacycle - Amine - Organic oxide - Organopnictogen compound - Primary amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
• 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.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Air sensitive
• Peso molecular: 300.340 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 300.068 Da
• Monoisotopic Mass: 300.068 Da
• Topological Polar Surface Area: 106.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 442.000
• 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

Referencias

1. Jing Wang, Yong Zhang, Fubin Liu, Ying Liu, Litao Wang, Guihua Gao.  (2023)  Preparation of a Multifunctional and Multipurpose Chitosan/Cyclodextrin/MIL-68(Al) Foam Column and Examining Its Adsorption Properties for Anionic and Cationic Dyes and Sulfonamides.  ACS Omega,      [PMID:37692232] [10.1021/acsomega.3c03897]

2. Meiling Ping, Wenchao Lv, Chen Yang, Qian Chen, Zongwen Wang, Fengfu Fu.  (2023)  A Paper-Based Multicolor Colorimetric Aptasensor for the Visual Determination of Multiple Sulfonamides Based on Aptamer-Functionalized Magnetic Beads and NADH–Ascorbic Acid-Mediated Gold Nanobipyramids.  Chemosensors,  11  (7): (386).  [PMID:] [10.3390/chemosensors11070386]

3. Zongwen Wang, Xiating Li, Feng Zhang, Yu Gao, Jintian Cheng, FengFu Fu.  (2023)  Regulating the Growth Rate of Gold Nanobipyramids via a HCl-NADH-Ascorbic Acid System toward a Dual-Channel Multicolor Colorimetric Immunoassay for Simultaneously Screening and Detecting Multiple Sulfonamides.  ANALYTICAL CHEMISTRY,      [PMID:37382204] [10.1021/acs.analchem.3c01928]

4. Yan Wu, Yue Zhou, Hongchen Long, Xiangyu Chen, Yuanyuan Jiang, Lei Zhang, Tao Le.  (2023)  A novel Zn/Eu-MOF for the highly sensitive, reversible and visualized sensing of ofloxacin residues in pork, beef and fish.  FOOD CHEMISTRY,      [PMID:37126953] [10.1016/j.foodchem.2023.136250]

5. Lulan Yang, Xingyue Chen, Xu Wen, Jiaming Tang, Xiaoling Zheng, Jiaqi Li, Lingling Chen, Shuang Jiang, Tao Le.  (2022)  A label-free dual-modal aptasensor for colorimetric and fluorescent detection of sulfadiazine.  Journal of Materials Chemistry B,  10  (32): (6187-6193).  [PMID:35894788] [10.1039/D2TB01115H]

6. Mengxia Qian, Fangfang Yang, Nan Li, Junting Gao, Xiufang Chen, Tiefeng Xu, Zhexin Zhu, Wangyang Lu, Wenxing Chen.  (2021)  A novel biodegradable porous graphitic carbon nitride/poly(lactic acid) fiber photocatalyst for efficient elimination of carbamazepine under solar irradiation.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.128845]

7. Hong Bin, Ba Yongbing, Niu Li, Lou Fei, Zhang Zhaohuan, Liu Haiquan, Pan Yingjie, Zhao Yong.  (2018)  A Comprehensive Research on Antibiotic Resistance Genes in Microbiota of Aquatic Animals.  Frontiers in Microbiology,      [PMID:30093887] [10.3389/fmicb.2018.01617]

8. Dandan Qin, Wangyang Lu, Zhexin Zhu, Nan Li, Tiefeng Xu, Gangqiang Wang, Wenxing Chen.  (2017)  Free Channel Formation around Graphitic Carbon Nitride Embedded in Porous Polyethylene Terephthalate Nanofibers with Excellent Reusability for Eliminating Antibiotics under Solar Irradiation.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.7b02800]

9. Xiuna Jia, Pan Zhao, Xiu Ye, Lianjun Zhang, Ting Wang, Qinyu Chen, Xiaohong Hou.  (2016)  A novel metal-organic framework composite MIL-101(Cr)@GO as an efficient sorbent in dispersive micro-solid phase extraction coupling with UHPLC-MS/MS for the determination of sulfonamides in milk samples.  TALANTA,      [PMID:28411816] [10.1016/j.talanta.2016.08.086]

10. Xiuping He, Liju Tan, Wei Wu, Jiangtao Wang.  (2016)  Determination of sulfadiazine in eggs using molecularly imprinted solid-phase extraction coupled with high-performance liquid chromatography.  JOURNAL OF SEPARATION SCIENCE,  39  (11): (2204-2212).  [PMID:27063936] [10.1002/jssc.201600233]

11. Yue Zhou, Yuanyuan Jiang, Xiangyu Chen, Hongchen Long, Mao Zhang, Zili Tang, Yufang He, Lei Zhang, Tao Le.  (2024)  Enhanced Sensitivity and Accuracy of Tb3+-Functionalized Zirconium-Based Bimetallic MOF for Visual Detection of Malachite Green in Fish.  Foods,  13  (17): (2855).  [PMID:39272620] [10.3390/foods13172855]

12. Cheng Liu, Zhu Zhexin, Wang Gangqiang, Du Shiting.  (2025)  g-C3N4 Enhanced Fe3+/ Fe2+ Cycling to Activate PMS for Pharmaceuticals Degradation Under Solar Irradiation.  CATALYSIS LETTERS,  155  (4): (1-19).  [PMID:] [10.1007/s10562-025-04979-w]

13. Yong Zhang, Jing Wang, Fubin Liu, Litao Wang, Guihua Gao.  (2024)  Preparation of cylindrical Chitosan/β-Cyclodextrin/MIL-68(Al) foam column for solid-phase extraction of sulfonamides in water, urine, and milk.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:38955130] [10.1016/j.chroma.2024.465130]

14. Huiting Feng, Yuxin Yang, Ruiling Li, Yuting Yang, Zongwen Wang, FengFu Fu, Yue Lin.  (2026)  Employment of mixed aptamers and gold nanobipyramids toward a paper-based aptasensor for simultaneously visual screening and accurate detection of eight sulfonamides.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:] [10.1016/j.saa.2026.127574]