Navocaftor - ≥99% , Cystic fibrosis transmembrane conductance regulator positive modulator, CAS No.2159103-66-7, Cystic fibrosis transmembrane conductance regulator positive modulator

CAS: 2159103-66-7 Cat. No.: N651324 Summenformel: C₁₅H₁₁F₃N₄O₅S Molekulargewicht: 416.33 PubChem CID: 132189640

GRADE & PURITY ≥99%

Synonyms

Navocaftor | CHEMBL4802150 | Navocaftor [USAN:INN] | [5-[3-amino-5-[4-(trifluoromethoxy)phenyl]sulfonylpyridin-2-yl]-1,3,4-oxadiazol-2-yl]methanol | ABBV-3067 | MS-27234 | 1,3,4-Oxadiazole-2-methanol, 5-(3-amino-5-((4-(trifluoromethoxy)phenyl)sulfonyl)-2-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Navocaftor (GLPG 3067), as a cystic fibrosis transmembrane regulator ( CFTR ), is a protein modulator (US 20200377491 Al, example 1)

In Vitro

Navocaftor, as a cystic fibrosis transmembrane regulator ( CFTR ), is a protein modulator. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:CFTR

Specifications

Synonyme

Navocaftor | CHEMBL4802150 | Navocaftor [USAN:INN] | [5-[3-amino-5-[4-(trifluoromethoxy)phenyl]sulfonylpyridin-2-yl]-1,3,4-oxadiazol-2-yl]methanol | ABBV-3067 | MS-27234 | 1,3,4-Oxadiazole-2-methanol, 5-(3-amino-5-((4-(trifluoromethoxy)phenyl)sulfonyl)-2-

Spezifikationen & Reinheit

≥99%

Biochemische und physiologische Mechanismen

Navocaftor (GLPG 3067), as a cystic fibrosis transmembrane regulator ( CFTR ), is a protein modulator (US 20200377491 Al, example 1).

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

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

Aktionsart

POSITIVE MODULATOR

Mechanismus der Wirkung

Cystic fibrosis transmembrane conductance regulator positive modulator

Reinheit

≥99%

Produkteigenschaften

• ALogP: 0.8

Namen und Kennungen

• Kanonisches Lächeln: C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)C2=CC(=C(N=C2)C3=NN=C(O3)CO)N
• IUPAC Name: [5-[3-amino-5-[4-(trifluoromethoxy)phenyl]sulfonylpyridin-2-yl]-1,3,4-oxadiazol-2-yl]methanol
• InChIKey: WOXOLLSAICIZNO-UHFFFAOYSA-N
• INCHI: 1S/C15H11F3N4O5S/c16-15(17,18)27-8-1-3-9(4-2-8)28(24,25)10-5-11(19)13(20-6-10)14-22-21-12(7-23)26-14/h1-6,23H,7,19H2
• Isomere SMILES: C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)C2=CC(=C(N=C2)C3=NN=C(O3)CO)N
• PubChem CID: 132189640
• Molekulargewicht: 416.33

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Benzenesulfonyl compounds

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Benzenesulfonyl compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonyl compounds
• Alternative Parents: Phenoxy compounds Phenol ethers Aminopyridines and derivatives Sulfones Heteroaromatic compounds 1,3,4-oxadiazoles Trihalomethanes Oxacyclic compounds Azacyclic compounds Primary amines Primary alcohols Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Benzenesulfonyl group - Phenoxy compound - Phenol ether - Aminopyridine - Pyridine - Heteroaromatic compound - Sulfonyl - Sulfone - Oxadiazole - Azole - 1,3,4-oxadiazole - Trihalomethane - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Halomethane - Hydrocarbon derivative - Aromatic alcohol - Primary amine - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: DMSO : <1 mg/mL (ultrasonic) (insoluble or slightly soluble)