CK 666 - ≥99% , CAS No.442633-00-3

CAS: 442633-00-3 Cat. No.: C275458 Summenformel: C₁₈H₁₇FN₂O Molekulargewicht: 296.34 EG-Nummer: 687-170-5

QUALITÄT & REINHEIT ≥99%

Synonyms

CK-0944666 | UXRKUKRXVWJFER-UHFFFAOYSA-N | 2-fluoro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide | 2-Fluoro-N-[2-(2-methyl-1H-indol-3-yl)-ethyl]-benzamide | SCHEMBL3382638 | CK 666 | Z1038843750 | STK766770 | HY-16926 | 2-Fluoro-N-(2-(2-methyl-1H-indol-3-

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Übersicht

Store at -20°C. Store under desiccating conditions. The product can be stored for up to 12 months.

Spezifikationen

Synonyme

CK-0944666 | UXRKUKRXVWJFER-UHFFFAOYSA-N | 2-fluoro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide | 2-Fluoro-N-[2-(2-methyl-1H-indol-3-yl)-ethyl]-benzamide | SCHEMBL3382638 | CK 666 | Z1038843750 | STK766770 | HY-16926 | 2-Fluoro-N-(2-(2-methyl-1H-indol-3-

Spezifikationen & Reinheit

≥99%

Biochemische und physiologische Mechanismen

Potent inhibitor of actin polymerization. Inhibits the Arp2/3 (IC 50 = 17 μM), SpArp2/3 (IC 50 = 5 μM) and HsArp2/3 complexes (IC 50 = 4 μM) by preventing a shift into an active conformation.

Storage

Store at -20°C,Desiccated

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Hinweis

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Reinheit

≥99%

Namen und Kennungen

Pubchem Sid

504759400

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759400

Kanonisches Lächeln

CC1=C(C2=CC=CC=C2N1)CCNC(=O)C3=CC=CC=C3F

IUPAC Name

2-fluoro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide

InChIKey

UXRKUKRXVWJFER-UHFFFAOYSA-N

INCHI

1S/C18H17FN2O/c1-12-13(14-6-3-5-9-17(14)21-12)10-11-20-18(22)15-7-2-4-8-16(15)19/h2-9,21H,10-11H2,1H3,(H,20,22)

Isomere SMILES

CC1=C(C2=CC=CC=C2N1)CCNC(=O)C3=CC=CC=C3F

Molekulargewicht

296.34

Reaxy-Rn

19720234

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19720234&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 3-alkylindoles
• Alternative Parents: 2-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Fluorobenzenes Substituted pyrroles Aryl fluorides Vinylogous halides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 3-alkylindole - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Vinylogous halide - Pyrrole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Beschreibung: 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: organofluorine compound - indoles - benzamides

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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in DMSO to 100 mM and in ethanol to 100 mM
• Molekulargewicht: 296.300 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 296.132 Da
• Monoisotopic Mass: 296.132 Da
• Topological Polar Surface Area: 44.900 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 389.000
• 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