ARRY-382 - Moligand™ , Inhibitor of colony stimulating factor 1 receptor, CAS No.1313407-95-2, Inhibitor of colony stimulating factor 1 receptor

CAS: 1313407-95-2 Cat. No.: A413028 Peso molecular: 564.7

GRADE & PURITY Moligand™

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Information

ARRY-382 is a potent, oral and highly selective inhibitor of c-Fms tyrosine kinase(CSF1R) with IC50 of 9 nM.

Specifications

Especificaciones y pureza

Moligand™

Mecanismos bioquímicos y fisiológicos

ARRY-382 is a potent, oral and highly selective inhibitor of c-Fms tyrosine kinase(CSF1R) with IC50 of 9 nM.

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

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

Grado

Moligand™

Tipo de acción

INHIBITOR

Mecanismo de acción

Inhibitor of colony stimulating factor 1 receptor

Propiedades del producto

• ALogP: 3.9

Nombres e identificadores

• Sonrisas canónicas: CC1=NC(=CC=C1)CN2C3=CC=CC(=C3C(=N2)C4CC4)NC(=O)C5=CN=C6N5C=CC(=C6)OCCN7CCN(CC7)C
• IUPAC Name: N-[3-cyclopropyl-1-[(6-methylpyridin-2-yl)methyl]indazol-4-yl]-7-[2-(4-methylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxamide
• InChIKey: JUPOTOIJLKDAPF-UHFFFAOYSA-N
• INCHI: 1S/C32H36N8O2/c1-22-5-3-6-24(34-22)21-40-27-8-4-7-26(30(27)31(36-40)23-9-10-23)35-32(41)28-20-33-29-19-25(11-12-39(28)29)42-18-17-38-15-13-37(2)14-16-38/h3-8,11-12,19-20,23H,9-10,13-18,21H2,1-2H3,(H,35,41)
• Isómeros SMILES: CC1=NC(=CC=C1)CN2C3=CC=CC(=C3C(=N2)C4CC4)NC(=O)C5=CN=C6N5C=CC(=C6)OCCN7CCN(CC7)C
• Peso molecular: 564.7
• Reaxy-Rn: 21626204
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21626204&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Imidazopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Imidazopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidazopyridines
• Alternative Parents: Pyridinecarboxamides Imidazo[1,2-a]pyridines Indazoles 2-heteroaryl carboxamides Alkyl aryl ethers Carbonylimidazoles N-methylpiperazines Methylpyridines Benzenoids N-substituted imidazoles Heteroaromatic compounds Pyrazoles Trialkylamines Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzopyrazole - Imidazo[1,2-a]pyridine - Imidazopyridine - Indazole - Pyridinecarboxamide - 2-heteroaryl carboxamide - Alkyl aryl ether - Imidazole-4-carbonyl group - Methylpyridine - N-alkylpiperazine - N-methylpiperazine - 1,4-diazinane - Benzenoid - N-substituted imidazole - Piperazine - Pyridine - Azole - Imidazole - Heteroaromatic compound - Pyrazole - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as imidazopyridines. These are organic polycyclic compounds containing an imidazole ring fused to a pyridine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
• 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)

CSF1R Tclin Macrophage colony-stimulating factor 1 receptor (1 Activities)

Discover Target: CSF1R

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Mecanismos de acción

Propiedades químicas y físicas

• Peso molecular: 564.700 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 564.296 Da
• Monoisotopic Mass: 564.296 Da
• Topological Polar Surface Area: 92.800 Ų
• Heavy Atom Count: 42
• Formal Charge: 0
• Complexity: 913.000
• 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