WAY-299582 - 10mM in DMSO , CAS No.118121-89-4

CAS: 118121-89-4 Cat. No.: W420803 Peso molecular: 213.22 PubChem CID: 676540

GRADE & PURITY 10mM in DMSO

Synonyms

4-(5-Fluoro-2-hydrazinopyrimidin-4-yl)morpholine | BS-36807 | STL380121 | 4-(5-Fluoro-2-hydrazino-4-pyrimidinyl)morpholine | WAY-299582 | (5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)hydrazine | DTXSID60350311 | Oprea1_751095 | SCHEMBL3579929 | AKOS000421051

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Descripción general

KDM5A inhibitor

Specifications

Sinónimos

4-(5-Fluoro-2-hydrazinopyrimidin-4-yl)morpholine | BS-36807 | STL380121 | 4-(5-Fluoro-2-hydrazino-4-pyrimidinyl)morpholine | WAY-299582 | (5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)hydrazine | DTXSID60350311 | Oprea1_751095 | SCHEMBL3579929 | AKOS000421051

Especificaciones y pureza

10mM in DMSO

Condiciones de almacenamiento de almacenamiento

Store at -80°C

Enviado en

Dry ice packs + Cold packs

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nombres e identificadores

• Sonrisas canónicas: C1COCCN1C2=NC(=NC=C2F)NN
• IUPAC Name: (5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)hydrazine
• InChIKey: GUQPHPDSFPNIPH-UHFFFAOYSA-N
• INCHI: 1S/C8H12FN5O/c9-6-5-11-8(13-10)12-7(6)14-1-3-15-4-2-14/h5H,1-4,10H2,(H,11,12,13)
• Isómeros SMILES: C1COCCN1C2=NC(=NC=C2F)NN
• PubChem CID: 676540
• Peso molecular: 213.22

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Tertiary alkylarylamines
            • Level7 Dialkylarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Dialkylarylamines
• Alternative Parents: Halopyrimidines Aminopyrimidines and derivatives Morpholines Imidolactams Aryl fluorides Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Hydrazines and derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Dialkylarylamine - Aminopyrimidine - Halopyrimidine - Aryl fluoride - Aryl halide - Morpholine - Oxazinane - Imidolactam - Pyrimidine - Heteroaromatic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrazine derivative - Organopnictogen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic 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

Mecanismos de acción

Propiedades químicas y físicas

• Peso molecular: 213.210 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 213.103 Da
• Monoisotopic Mass: 213.103 Da
• Topological Polar Surface Area: 76.300 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 201.000
• 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