IFN alpha-IFNAR-IN-1 hydrochloride - Moligand™, ≥98% , CAS No.2070014-98-9

CAS: 2070014-98-9 Cat. No.: I692993 Peso molecular: 315.86 PubChem CID: 72193873

GRADE & PURITY Moligand™, ≥98%

Synonyms

N-Methyl-1-(2-(naphthalen-1-ylthio)phenyl)methanamine hydrochloride

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Descripción general

IFN alpha-IFNAR-IN-1 hydrochloride is a nonpeptidic, low-molecular-weight inhibitor of the interaction between IFN-α and IFNAR. IFN alpha-IFNAR-IN-1 hydrochloride inhibits modified Vaccinia virus ankara (MVA)-induced IFN-α responses in murine bone-marrow-derived, Flt3- L-differentiated pDC cultures (BM-pDCs) (IC50=2-8 μM).

Specifications

Sinónimos

N-Methyl-1-(2-(naphthalen-1-ylthio)phenyl)methanamine hydrochloride

Especificaciones y pureza

Moligand™, ≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Desiccated

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Moligand™

Tipo de acción

INHIBITOR

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CNCC1=CC=CC=C1SC2=CC=CC3=CC=CC=C32.Cl
• IUPAC Name: N-methyl-1-(2-naphthalen-1-ylsulfanylphenyl)methanamine;hydrochloride
• InChIKey: QTESJCPDPNGOLF-UHFFFAOYSA-N
• INCHI: 1S/C18H17NS.ClH/c1-19-13-15-8-3-5-11-17(15)20-18-12-6-9-14-7-2-4-10-16(14)18;/h2-12,19H,13H2,1H3;1H
• Isómeros SMILES: CNCC1=CC=CC=C1SC2=CC=CC3=CC=CC=C32.Cl
• PubChem CID: 72193873
• Peso molecular: 315.86

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Clase Thioethers
      • Subclass Aryl thioethers

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Clase: Thioethers
• Subclass: Aryl thioethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diarylthioethers
• Alternative Parents: Naphthalenes Thiophenol ethers Phenylmethylamines Benzylamines Aralkylamines Sulfenyl compounds Dialkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Diarylthioether - Naphthalene - Benzylamine - Phenylmethylamine - Thiophenol ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Secondary aliphatic amine - Sulfenyl compound - Secondary amine - Hydrochloride - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
• 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

Objetivos asociados (humanos)

IFNAR1 Tclin Interferon-alpha/beta receptor alpha chain (50 Activities)

Discover Target: IFNAR1

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

Objetivos asociados (no humanos)

Trypanosoma brucei brucei (13300 Activities)

Explore this target

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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Peso molecular: 279.400 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 279.108 Da
• Monoisotopic Mass: 279.108 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 293.000
• 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