olsalazine - Moligand™, ≥96% , CAS No.15722-48-2

CAS: 15722-48-2 Cat. No.: O612484 Formula: C₁₄H₁₀N₂O₆ Peso molecolare: 302.24 Numero EC: 605-089-5 PubChem CID: 22419

GRADE & PURITY Moligand™, ≥96%

Synonyms

DTXSID8023391 | Salicylic acid, 5,5'-azodi- | Olsalazina | OLSALAZINE [INN] | 5-[(3-carboxy-4-hydroxyphenyl)diazenyl]-2-hydroxybenzoic acid | CHEBI:7770 | Rasal | 5,5'-(diazene-1,2-diyl)bis(2-hydroxybenzoic acid) | PD055722 | QQBDLJCYGRGAKP-UHFFFAOYSA-N |

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Sinonimi

DTXSID8023391 | Salicylic acid, 5,5'-azodi- | Olsalazina | OLSALAZINE [INN] | 5-[(3-carboxy-4-hydroxyphenyl)diazenyl]-2-hydroxybenzoic acid | CHEBI:7770 | Rasal | 5,5'-(diazene-1,2-diyl)bis(2-hydroxybenzoic acid) | PD055722 | QQBDLJCYGRGAKP-UHFFFAOYSA-N |

Specifiche e purezza

Moligand™, ≥96%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Protected from light

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Grado

Moligand™

Tipo di azione

INHIBITOR

Purezza

≥96%

Nomi e identificatori

• Pubchem Sid: 528768714
• Sorrisi canonici: C1=CC(=C(C=C1N=NC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O
• IUPAC Name: 5-[(3-carboxy-4-hydroxyphenyl)diazenyl]-2-hydroxybenzoic acid
• InChIKey: QQBDLJCYGRGAKP-UHFFFAOYSA-N
• INCHI: 1S/C14H10N2O6/c17-11-3-1-7(5-9(11)13(19)20)15-16-8-2-4-12(18)10(6-8)14(21)22/h1-6,17-18H,(H,19,20)(H,21,22)
• Isomeri SMILES: C1=CC(=C(C=C1N=NC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O
• CAS alternativo: 15722-48-2,6054-98-4 (di-hydrochloride salt)
• PubChem CID: 22419
• Termini MeSH: azodisal sodium;azodisalicylate;CJ-91B;Dipentum;disodium 5,5'-azodisalicylate;disodium azodisalicylate;olsalazine;olsalazine sodium;olsalazine, disodium salt;Rasal;sodium diazosalicylate
• Peso molecolare: 302.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Azobenzenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azobenzenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azobenzenes
• Alternative Parents: Salicylic acids Benzoic acids Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Dicarboxylic acids and derivatives Vinylogous acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Azobenzene - Hydroxybenzoic acid - Salicylic acid or derivatives - Salicylic acid - Benzoic acid or derivatives - Benzoic acid - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Vinylogous acid - Azo compound - Organic 1,3-dipolar compound - Carboxylic acid - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated to a benzene ring.
• External Descriptors: azobenzenes - dicarboxylic acid

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

Proprietà chimiche e fisiche

• Sensibilità: light sensitive
• Peso molecolare: 302.240 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 302.054 Da
• Monoisotopic Mass: 302.054 Da
• Topological Polar Surface Area: 140.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 415.000
• 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

Riferimenti

1. Yan Yan, Jinyao Sun, Xianting Xie, Pengchong Wang, Ying Sun, Yalin Dong, Jianfeng Xing.  (2018)  Colon-targeting mutual prodrugs of 5-aminosalicylic acid and butyrate for the treatment of ulcerative colitis.  RSC Advances,  8  (5): (2561-2574).  [PMID:35541446] [10.1039/C7RA13011B]