Surf dihydrochloride - ≥98%(HPLC) , CAS No.5424-37-3

CAS: 5424-37-3 Cat. No.: S286940 Formule: C₂₁H₂₂Cl₂N₆O Poids moléculaire: 445.35 PubChem CID: 79472

GRADE & PURITY ≥98%(HPLC)

Synonyms

AKOS030527176 | EINECS 226-566-0 | Tox21_110013 | 1,3-Bis(4-amino-2-methyl-6-quinolyl)urea dihydrochloride | DTXSID1045083 | NSC 12155 | MFCD00051734 | Surfen dihydrochloride | Aminoquincarbamide dihydrochloride | Luminor Yellow Green 490RT | P2YT71SUIU |

Storage

Conserver à -20°C

Shipped In

Glacière + blocs de glace

Vue d’ensemble

Description du produit :

Le dihydrochlorure de surfen est un antagoniste puissant du HS (héparane sulfate). Surfen se lie aux glycosaminoglycanes. Surfen neutralise l'activité anticoagulante des héparines non fractionnées et des héparines de faible poids moléculaire. Surfen affecte la sulfatation de l'héparine et inhibe la dégradation par les héparines lyases. Surfen inhibe la liaison et la signalisation du FGF2. Surfen inhibe l'attachement cellulaire et l'infection virale.

Specifications

Synonymes

AKOS030527176 | EINECS 226-566-0 | Tox21_110013 | 1,3-Bis(4-amino-2-methyl-6-quinolyl)urea dihydrochloride | DTXSID1045083 | NSC 12155 | MFCD00051734 | Surfen dihydrochloride | Aminoquincarbamide dihydrochloride | Luminor Yellow Green 490RT | P2YT71SUIU |

Spécifications et pureté

≥98%(HPLC)

Mécanismes biochimiques et physiologiques

Antagoniste de l'héparane sulfate. Inhibe l'attachement cellulaire médié par l'héparane sulfate in vitro. Maintient les CSEh dans un état pluripotent par l'inhibition réversible des interactions glycanes-facteurs de croissance.

Conditions de stockage de stockage

Conserver à -20°C

Expédié en

Glacière + blocs de glace

Pureté

≥98%(HPLC)

Noms et identifiants

Pubchem Sid

504755377

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755377

Sourires canoniques

CC1=CC(=C2C=C(C=CC2=N1)NC(=O)NC3=CC4=C(C=C(N=C4C=C3)C)N)N.Cl.Cl

IUPAC Name

1,3-bis(4-amino-2-methylquinolin-6-yl)urea;dihydrochloride

InChIKey

GKQYGRWQCWWSHN-UHFFFAOYSA-N

INCHI

1S/C21H20N6O.2ClH/c1-11-7-17(22)15-9-13(3-5-19(15)24-11)26-21(28)27-14-4-6-20-16(10-14)18(23)8-12(2)25-20;;/h3-10H,1-2H3,(H2,22,24)(H2,23,25)(H2,26,27,28);2*1H

Isomères SMILES

CC1=CC(=C2C=C(C=CC2=N1)NC(=O)NC3=CC4=C(C=C(N=C4C=C3)C)N)N.Cl.Cl

PubChem CID

79472

Poids moléculaire

445.35

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Quinolines and derivatives
      • Subclass Aminoquinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Quinolines and derivatives
• Subclass: Aminoquinolines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: 4-aminoquinolines
• Alternative Parents: Methylpyridines Aminopyridines and derivatives Benzenoids Heteroaromatic compounds Ureas Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 4-aminoquinoline - Aminopyridine - Methylpyridine - Pyridine - Benzenoid - Heteroaromatic compound - Urea - Carbonic acid derivative - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Hydrochloride - Organic nitrogen compound - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 4-aminoquinolines. These are organic compounds containing an amino group attached to the 4-position of a quinoline ring system.
• 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

Cibles associées (humaines)

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Solvent:water, Max Conc. mg/mL: 8.91, Max Conc. mM: 20; Solvent:DMSO, Max Conc. mg/mL: 8.91, Max Conc. mM: 20
• Sensibilité: light sensitive；Moisture sensitive.
• Poids moléculaire: 445.300 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 444.123 Da
• Monoisotopic Mass: 444.123 Da
• Topological Polar Surface Area: 119.000 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 513.000
• 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: 3

XLogP3

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 5424-37-3, the molecular formula is C21H22Cl2N6O, and the molecular weight is 445.35 g/mol. InChIKey GKQYGRWQCWWSHN-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.