[³H]ZM 241385 - Moligand™ , Antagonist of A 2A receptor;Antagonist of A 2B receptor, CAS No.H614261, Antagonist of A 2A receptor;Antagonist of A 2B receptor

CAS: H614261 Cat. No.: H614261 PubChem CID: 53316647

GRADE & PURITY Moligand™

Synonyms

[³H]-ZM241385

Storage

Room temperature

Specifications

Synonyms

[³H]-ZM241385

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

ANTAGONIST

Mechanism of action

Antagonist of A 2A receptor;Antagonist of A 2B receptor

Names and Identifiers

• Canonical Smiles: c1([3H])cc(CCNc2nc(N)n3c(n2)nc(n3)c2ccco2)ccc1O
• IUPAC Name: 4-[2-[[7-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl]amino]ethyl]-2-tritiophenol
• InChIKey: PWTBZOIUWZOPFT-XHHURNKPSA-N
• INCHI: 1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)/i5T
• Isomeric SMILES: [3H]C1=CC(=CC=C1O)CCNC2=NC3=NC(=NN3C(=N2)N)C4=CC=CO4
• PubChem CID: 53316647

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Triazines
      • Subclass Aminotriazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Triazines
• Subclass: Aminotriazines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,3,5-triazine-2,4-diamines
• Alternative Parents: N-aliphatic s-triazines 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives 1,3,5-triazines Triazoles Heteroaromatic compounds Furans Oxacyclic compounds Azacyclic compounds Primary amines Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 2,4-diamine-s-triazine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - N-aliphatic s-triazine - Monocyclic benzene moiety - Benzenoid - 1,3,5-triazine - Azole - Furan - 1,2,4-triazole - Heteroaromatic compound - Oxacycle - Azacycle - Amine - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,3,5-triazine-2,4-diamines. These are aromatic compounds containing a 1,3,5-triazine ring which is 2,4-disusbtituted wit amine groups.
• 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

Associated Targets(Human)

ADORA2A Tclin Adenosine receptor A2a (0 Activities)

Discover Target: ADORA2A

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

ADORA2B Tclin Adenosine receptor A2b (0 Activities)

Discover Target: ADORA2B

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

Mechanisms of Action