aza-THIP - Moligand™ , Antagonist of GABA A receptor ρ1 subunit;Antagonist of GABA A receptor ρ2 subunit;Antagonist of GABA A receptor ρ3 subunit, CAS No.A607850, Antagonist of GABA A receptor ρ1 subunit;Antagonist of GABA A receptor ρ2 subunit;Antagonist of GABA A receptor ρ3 subunit

CAS: A607850 Cat. No.: A607850 PubChem CID: 55285412

GRADE & PURITY Moligand™

Synonyms

SCHEMBL21801015 | 1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridin-3-ol | SCHEMBL2946381 | UPMMUUFLHUEUKP-UHFFFAOYSA-N | SCHEMBL16057201 | AKOS022182337 | DTXSID20717441 | EN300-147300 | 4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridin-3-ol | aza-THIP | 4,5,6,7-tetrahyd

Storage

Room temperature

Specifications

Synonyme

SCHEMBL21801015 | 1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridin-3-ol | SCHEMBL2946381 | UPMMUUFLHUEUKP-UHFFFAOYSA-N | SCHEMBL16057201 | AKOS022182337 | DTXSID20717441 | EN300-147300 | 4,5,6,7-tetrahydro-2H-pyrazolo[3,4-c]pyridin-3-ol | aza-THIP | 4,5,6,7-tetrahyd

Spezifikationen & Reinheit

Moligand™

Storage

Room temperature

Note

Moligand™

Aktionsart

ANTAGONIST

Mechanismus der Wirkung

Antagonist of GABA A receptor ρ1 subunit;Antagonist of GABA A receptor ρ2 subunit;Antagonist of GABA A receptor ρ3 subunit

Namen und Kennungen

• Kanonisches Lächeln: Oc1n[nH]c2c1CCNC2
• IUPAC Name: 1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridin-3-ol
• InChIKey: UPMMUUFLHUEUKP-UHFFFAOYSA-N
• INCHI: 1S/C6H9N3O/c10-6-4-1-2-7-3-5(4)8-9-6/h7H,1-3H2,(H2,8,9,10)
• Isomere SMILES: C1CNCC2=C1C(=O)NN2
• PubChem CID: 55285412

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Amines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aralkylamines
• Alternative Parents: Pyrazolones Vinylogous amides Pyrazoles Heteroaromatic compounds Lactams Dialkylamines Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Aralkylamine - Pyrazolinone - Azole - Pyrazole - Vinylogous amide - Heteroaromatic compound - Lactam - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Azacycle - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl 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)

GABRR1 Tchem Gamma-aminobutyric acid receptor subunit rho-1 (0 Activities)

Discover Target: GABRR1

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

GABRR3 Tbio Gamma-aminobutyric acid receptor subunit rho-3 (0 Activities)

Discover Target: GABRR3

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

GABRR2 Tchem Gamma-aminobutyric acid receptor subunit rho-2 (0 Activities)

Discover Target: GABRR2

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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 139.160 g/mol
• XLogP3: -0.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 139.075 Da
• Monoisotopic Mass: 139.075 Da
• Topological Polar Surface Area: 53.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 209.000
• 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 A607850. InChIKey UPMMUUFLHUEUKP-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.