SU5205 - ≥98% , CAS No.3476-86-6

CAS: 3476-86-6 Cat. No.: S413644 Fórmula: C₁₅H₁₀FNO Peso molecular: 239.24 PubChem CID: 5398217

GRAU & PUREZA ≥98%

Synonyms

2H-​Indol-​2-​one,3-​[(4-​fluorophenyl)​methylene]​-​1,​3-​dihydro-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Information

SU5205 is an inhibitor ofVEGF receptor 2 (VEGFR2/FLK-1)with IC50 of 9.6 µM.

Targets

VEGFR2 (Cell-free assay) 9.6 μM

Especificações

Sinónimos

2H-​Indol-​2-​one,3-​[(4-​fluorophenyl)​methylene]​-​1,​3-​dihydro-

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

SU5205 is an inhibitor of VEGF receptor 2 (VEGFR2/FLK-1) with IC50 of 9.6 µM.

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Propriedades do produto

ALogP

2.936

Contagem HBD

1

Ligação rotativa

1

Nomes e identificadores

Pubchem Sid

504763820

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504763820

Sorrisos canónicos

C1=CC=C2C(=C1)C(=CC3=CC=C(C=C3)F)C(=O)N2

IUPAC Name

(3Z)-3-[(4-fluorophenyl)methylidene]-1H-indol-2-one

InChIKey

QIERHADIMMFZNE-LCYFTJDESA-N

INCHI

1S/C15H10FNO/c16-11-7-5-10(6-8-11)9-13-12-3-1-2-4-14(12)17-15(13)18/h1-9H,(H,17,18)/b13-9-

SMILES isoméricas

C1=CC=C2C(=C1)/C(=C/C3=CC=C(C=C3)F)/C(=O)N2

PubChem CID

5398217

Peso molecular

239.24

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Indoles and derivatives
• Subclass: Indolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Indolines
• Alternative Parents: Fluorobenzenes Aryl fluorides Secondary carboxylic acid amides Lactams Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Dihydroindole - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as indolines. These are compounds containing an indole moiety, which consists of pyrrolidine ring fused to benzene to form 2,3-dihydroindole.
• 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 (humanos)

KDR Tclin Vascular endothelial growth factor receptor 2 (20924 Activities)

Discover Target: KDR

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

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Solubility (25°C) In vitro DMSO: 48 mg/mL (200.63 mM); Ethanol: 3 mg/mL (12.53 mM); Water: Insoluble
• DMSO (mg/mL) Solubilidade máxima: 48
• DMSO (mM) Solubilidade máxima: 200.63534525999
• Água (mg/mL) Solubilidade máxima: ＜1
• Peso molecular: 239.240 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 239.075 Da
• Monoisotopic Mass: 239.075 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 358.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). 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 3476-86-6, the molecular formula is C15H10FNO, and the molecular weight is 239.24 g/mol. InChIKey QIERHADIMMFZNE-LCYFTJDESA-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.