CK-636 - 10mM in DMSO , CAS No.442632-72-6

CAS: 442632-72-6 Cat. No.: C423999 Fórmula: C₁₆H₁₆N₂OS Peso molecular: 284.38 Número CE: 663-254-7

GRADE & PURITY 10mM in DMSO

Synonyms

CK-636|442632-72-6|N-[2-(2-methyl-1H-indol-3-yl)ethyl]thiophene-2-carboxamide|CK-0944636|N-(2-(2-methyl-1H-indol-3-yl)ethyl)thiophene-2-carboxamide|CK 636|82XC8RSD8V|N-[2-(2-methylindol-3-yl)ethyl]-2-thienylcarboxamide|N-(2-(2-Methylindol-3-yl)ethyl)-2-th

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Visão geral

CK-636 is an Arp2/3 complex inhibitor with IC50 of 4 μM, 24 μM and 32 μM for inhibition of actin polymerization induced by human, fission yeast and bovine Arp2/3 complex, respectively

Specifications

Sinónimos

CK-636 | 442632-72-6 | N-[2-(2-methyl-1H-indol-3-yl)ethyl]thiophene-2-carboxamide | CK-0944636 | N-(2-(2-methyl-1H-indol-3-yl)ethyl)thiophene-2-carboxamide | CK 636 | 82XC8RSD8V | N-[2-(2-methylindol-3-yl)ethyl]-2-thienylcarboxamide | N-(2-(2-Methylindol-3-yl)ethyl)-2-th

Especificações e pureza

10mM in DMSO

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.

Tipo de ação

INHIBITOR

Nomes e identificadores

• Pubchem Sid: 528763748
• Sorrisos canónicos: CC1=C(C2=CC=CC=C2N1)CCNC(=O)C3=CC=CS3
• IUPAC Name: N-[2-(2-methyl-1H-indol-3-yl)ethyl]thiophene-2-carboxamide
• InChIKey: ACAKNPKRLPMONU-UHFFFAOYSA-N
• INCHI: 1S/C16H16N2OS/c1-11-12(13-5-2-3-6-14(13)18-11)8-9-17-16(19)15-7-4-10-20-15/h2-7,10,18H,8-9H2,1H3,(H,17,19)
• SMILES isoméricas: CC1=C(C2=CC=CC=C2N1)CCNC(=O)C3=CC=CS3
• WGK Alemanha: 3
• Peso molecular: 284.38
• Reaxy-Rn: 19720231
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19720231&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Indoles and derivatives
      • Subclass Indoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 3-alkylindoles
• Alternative Parents: Thiophene carboxamides 2-heteroaryl carboxamides Substituted pyrroles Benzenoids Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 3-alkylindole - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Substituted pyrrole - Benzenoid - Pyrrole - Thiophene - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
• 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

Alvos associados (não humanos)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mecanismos de ação

Propriedades químicas e físicas

• Peso molecular: 284.400 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 284.098 Da
• Monoisotopic Mass: 284.098 Da
• Topological Polar Surface Area: 73.100 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 349.000
• 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