Tenoxicam - 10mM in DMSO , CAS No.59804-37-4

CAS: 59804-37-4 Cat. No.: T424976 Fórmula: C₁₃H₁₁N₃O₄S₂ Peso molecular: 337.37 Número CE: 620-500-8 PubChem CID: 54677971

GRAU & PUREZA 10mM in DMSO

Synonyms

tenoxicam|59804-37-4|Mobiflex|Tilcotil|Tenoxicamum|Liman|Tenoxicamum [INN-Latin]|Ro 12-0068|Ro-12-0068|Ro 12-0068/000|4-hydroxy-2-methyl-N-(pyridin-2-yl)-2H-thieno[2,3-e][1,2]thiazine-3-carboxamide 1,1-dioxide|NSC-758397|MLS000069830|DTXSID8045486|CHEBI:3

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Visão geral

Tenoxicam is a good HO. radicals scavenger with an IC50 of 56.7 μM.
A nonsteroidal, anti-inflammatory, analgesic agent.

Especificações

Sinónimos

tenoxicam | 59804-37-4 | Mobiflex | Tilcotil | Tenoxicamum | Liman | Tenoxicamum [INN-Latin] | Ro 12-0068 | Ro-12-0068 | Ro 12-0068/000 | 4-hydroxy-2-methyl-N-(pyridin-2-yl)-2H-thieno[2,3-e][1,2]thiazine-3-carboxamide 1,1-dioxide | NSC-758397 | MLS000069830 | DTXSID8045486 | CHEBI:3

Especificações e pureza

10mM in DMSO

Mecanismos bioquímicos e fisiológicos

Tenoxicam is a nonsteroidal anti-inflammmatory(NSAID), analgesic agent. Displays antitumor effects

Condições de armazenamento de armazenamento

Store at -80°C

Enviado em

Dry ice packs + Cold packs

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Nomes e identificadores

Pubchem Sid

528772074

Sorrisos canónicos

CN1C(=C(C2=C(S1(=O)=O)C=CS2)O)C(=O)NC3=CC=CC=N3

IUPAC Name

4-hydroxy-2-methyl-1,1-dioxo-N-pyridin-2-ylthieno[2,3-e]thiazine-3-carboxamide

InChIKey

LZNWYQJJBLGYLT-UHFFFAOYSA-N

INCHI

1S/C13H11N3O4S2/c1-16-10(13(18)15-9-4-2-3-6-14-9)11(17)12-8(5-7-21-12)22(16,19)20/h2-7,17H,1H3,(H,14,15,18)

SMILES isoméricas

CN1C(=C(C2=C(S1(=O)=O)C=CS2)O)C(=O)NC3=CC=CC=N3

WGK Alemanha

2

RTECS

XJ9095060

PubChem CID

54677971

Peso molecular

337.37

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Thienothiazines N-arylamides Pyridines and derivatives Organosulfonamides Imidolactams 1,2-thiazines Vinylogous acids Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Alpha-amino acid or derivatives - Thienothiazine - N-arylamide - Ortho-thiazine - Pyridine - Imidolactam - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous acid - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• External Descriptors: monocarboxylic acid amide - pyridines - heteroaryl hydroxy compound - thienothiazine

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

Propriedades químicas e físicas

• Ponto de fusão (°C): 213 °C(dec.)
• Peso molecular: 337.400 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 337.019 Da
• Monoisotopic Mass: 337.019 Da
• Topological Polar Surface Area: 136.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 599.000
• 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