KA2507 - Moligand™,≥98% , CAS No.1636894-46-6

CAS: 1636894-46-6 Cat. No.: K646127 Summenformel: C₁₆H₁₄N₆O₂ Molekulargewicht: 322.32 PubChem CID: 117703516

GRADE & PURITY Moligand™, ≥98%

Synonyms

Benzamide, 4-((di-2-pyrazinylamino)methyl)-N-hydroxy- | UNII-VQ7NU11KRM | NSC833746 | NSC-833746 | MS-24772 | SCHEMBL16245665 | GTPL12269 | AKOS040759693 | 1636894-46-6 | HY-138799 | KA2507 | KA-2507 | VQ7NU11KRM | 4-[[di(pyrazin-2-yl)amino]methyl]-N-hydr

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Übersicht

KA2507 is a potent, orally active and selective HDAC6 inhibitor, with an IC 50 of 2.5 nM. KA2507 shows antitumor activities and immune modulatory effects in preclinical models

Specifications

Synonyme

Benzamide, 4-((di-2-pyrazinylamino)methyl)-N-hydroxy- | UNII-VQ7NU11KRM | NSC833746 | NSC-833746 | MS-24772 | SCHEMBL16245665 | GTPL12269 | AKOS040759693 | 1636894-46-6 | HY-138799 | KA2507 | KA-2507 | VQ7NU11KRM | 4-[[di(pyrazin-2-yl)amino]methyl]-N-hydr

Spezifikationen & Reinheit

Moligand™,≥98%

Storage

Store at 2-8°C,Protected from light

Verschickt in

Wet ice

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

Note

Moligand™

Aktionsart

INHIBITOR

Reinheit

≥98%

Namen und Kennungen

• Kanonisches Lächeln: C1=CC(=CC=C1CN(C2=NC=CN=C2)C3=NC=CN=C3)C(=O)NO
• IUPAC Name: 4-[[di(pyrazin-2-yl)amino]methyl]-N-hydroxybenzamide
• InChIKey: LXHMTDHBMRZSHJ-UHFFFAOYSA-N
• INCHI: 1S/C16H14N6O2/c23-16(21-24)13-3-1-12(2-4-13)11-22(14-9-17-5-7-19-14)15-10-18-6-8-20-15/h1-10,24H,11H2,(H,21,23)
• Isomere SMILES: C1=CC(=CC=C1CN(C2=NC=CN=C2)C3=NC=CN=C3)C(=O)NO
• Alternative CAS-Nummer: 1636894-46-6
• PubChem CID: 117703516
• Molekulargewicht: 322.32

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines
        • Ebene5 Tertiary amines
          • Ebene6 Tertiary alkylarylamines
            • Ebene7 Alkyldiarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Alkyldiarylamines
• Alternative Parents: Benzoic acids and derivatives Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines Aminopyrazines Imidolactams Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyldiarylamine - Benzoic acid or derivatives - Phenylmethylamine - Benzylamine - Benzoyl - Aralkylamine - Aminopyrazine - Imidolactam - Benzenoid - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alkyldiarylamines. These are tertiary alkylarylamines having two aryl and one alkyl groups attached to the amino 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 : 66.67 mg/mL (206.84 mM; Need ultrasonic)
• Molekulargewicht: 322.320 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 322.118 Da
• Monoisotopic Mass: 322.118 Da
• Topological Polar Surface Area: 104.000 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 384.000
• 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

Häufig gestellte Fragen

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.

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at 2–8 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships chilled on wet ice. 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 1636894-46-6, the molecular formula is C16H14N6O2, and the molecular weight is 322.32 g/mol. InChIKey LXHMTDHBMRZSHJ-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.