Febrifugine - ≥98% , CAS No.24159-07-7

CAS: 24159-07-7 Cat. No.: F649623 Fórmula: C₁₆H₁₉N₃O₃ Peso molecular: 301.34 Número CE: 683-166-2 PubChem CID: 115723

GRADE & PURITY ≥98%

Synonyms

(+)-Isofebrifugine | A924260 | Febrifugine | 3-(3-(3-Hydroxypiperidin-2-yl)-2-oxopropyl)quinazolin-4(3H)-one | NSC315535 | NSC-315535 | 3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one | .beta.-Dichroine | gamma-Dichroine | BCP15889 | FT-077630

Storage

Protected from light,Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Visão geral

Febrifugine is a quinazolinone alkaloid found in the roots and leaves of Dichroa febrifuga , with antimalarial activity

Form:Solid

IC50& Target:Plasmodium

Specifications

Sinónimos

(+)-Isofebrifugine | A924260 | Febrifugine | 3-(3-(3-Hydroxypiperidin-2-yl)-2-oxopropyl)quinazolin-4(3H)-one | NSC315535 | NSC-315535 | 3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one | .beta.-Dichroine | gamma-Dichroine | BCP15889 | FT-077630

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

Febrifugine is a quinazolinone alkaloid found in the roots and leaves of Dichroa febrifuga , with antimalarial activity.

Condições de armazenamento de armazenamento

Protected from light,Store at -20°C,Desiccated

Enviado em

Ice chest + Ice pads

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

Tipo de ação

INHIBITOR

Pureza

≥98%

Nomes e identificadores

Sorrisos canónicos

C1CC(C(NC1)CC(=O)CN2C=NC3=CC=CC=C3C2=O)O

IUPAC Name

3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]quinazolin-4-one

InChIKey

FWVHWDSCPKXMDB-UHFFFAOYSA-N

INCHI

1S/C16H19N3O3/c20-11(8-14-15(21)6-3-7-17-14)9-19-10-18-13-5-2-1-4-12(13)16(19)22/h1-2,4-5,10,14-15,17,21H,3,6-9H2

SMILES isoméricas

C1CC(C(NC1)CC(=O)CN2C=NC3=CC=CC=C3C2=O)O

PubChem CID

115723

Peso molecular

301.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinazolines
• Alternative Parents: Pyrimidones Piperidines Beta-amino ketones Benzenoids Heteroaromatic compounds Secondary alcohols Lactams 1,2-aminoalcohols Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinazoline - Pyrimidone - Beta-aminoketone - Piperidine - Pyrimidine - Benzenoid - Heteroaromatic compound - 1,2-aminoalcohol - Ketone - Lactam - Secondary alcohol - Secondary aliphatic amine - Azacycle - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Amine - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
• 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

Propriedades químicas e físicas

• Solubilidade: DMSO : 25 mg/mL (82.96 mM; Need ultrasonic)
• Peso molecular: 301.340 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 301.143 Da
• Monoisotopic Mass: 301.143 Da
• Topological Polar Surface Area: 82.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 466.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• 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, protected from light, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

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 24159-07-7, the molecular formula is C16H19N3O3, and the molecular weight is 301.34 g/mol. InChIKey FWVHWDSCPKXMDB-UHFFFAOYSA-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.