HT1042 - Moligand™ , Inhibitor of proteasome 20S subunit beta 8, CAS No.23589-77-7, Inhibitor of proteasome 20S subunit beta 8

CAS: 23589-77-7 Cat. No.: H610868 PubChem CID: 325597

GRADE & PURITY Moligand™

Synonyms

5-(3-nitrophenyl)-1,3,4-oxathiazol-2-one|HT1042|23589-77-7|CHEMBL3265177|NSC294566|GTPL8649|SCHEMBL1781484|DTXSID10315430|BDBM50010993|AKOS040748540|NSC-294566|Q27077995

Storage

Room temperature

Specifications

Synonyme

5-(3-nitrophenyl)-1,3,4-oxathiazol-2-one | HT1042 | 23589-77-7 | CHEMBL3265177 | NSC294566 | GTPL8649 | SCHEMBL1781484 | DTXSID10315430 | BDBM50010993 | AKOS040748540 | NSC-294566 | Q27077995

Spezifikationen & Reinheit

Moligand™

Storage

Room temperature

Note

Moligand™

Aktionsart

INHIBITOR

Mechanismus der Wirkung

Inhibitor of proteasome 20S subunit beta 8

Namen und Kennungen

• Kanonisches Lächeln: O=c1snc(o1)c1cccc(c1)[N+](=O)[O-]
• IUPAC Name: 5-(3-nitrophenyl)-1,3,4-oxathiazol-2-one
• InChIKey: QBAZATRGWRVUFN-UHFFFAOYSA-N
• INCHI: 1S/C8H4N2O4S/c11-8-14-7(9-15-8)5-2-1-3-6(4-5)10(12)13/h1-4H
• Isomere SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NSC(=O)O2
• PubChem CID: 325597

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Nitrobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrobenzenes
• Alternative Parents: Nitroaromatic compounds Heteroaromatic compounds Azoles Organic thiocarbonic acid derivatives Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Nitrobenzene - Nitroaromatic compound - Azole - Heteroaromatic compound - C-nitro compound - Thiocarbonic acid derivative - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Azacycle - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro 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

Zugehörige Ziele (menschlich)

PSMB8 Tclin Proteasome subunit beta type-8 (2 Activities)

Discover Target: PSMB8

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 224.200 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 223.989 Da
• Monoisotopic Mass: 223.989 Da
• Topological Polar Surface Area: 110.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 325.000
• 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 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 room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 23589-77-7. InChIKey QBAZATRGWRVUFN-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.