neladenoson - Moligand™ , Agonist of A 1 receptor, CAS No.N612215, Agonist of A 1 receptor

CAS: N612215 Cat. No.: N612215 PubChem CID: 46847262

GRADE & PURITY Moligand™

Synonyms

VZ2KZF4L9S | GTPL11222 | BAY1067197 (amide ester prodrug) | BAY 1067197 | SCHEMBL3726270 | 2-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-[4-(2-hydroxyethoxy)phenyl]-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile | 1239234-36-6 | neladenoson

Storage

Room temperature

Specifications

동의어

VZ2KZF4L9S | GTPL11222 | BAY1067197 (amide ester prodrug) | BAY 1067197 | SCHEMBL3726270 | 2-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-[4-(2-hydroxyethoxy)phenyl]-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile | 1239234-36-6 | neladenoson

사양 및 순도

Moligand™

보관 조건

Room temperature

등급

Moligand™

작업 유형

AGONIST

작동 메커니즘

Agonist of A 1 receptor

이름과 식별자

• 정식 스마일: OCCOc1ccc(cc1)c1c(C#N)c(SCc2csc(n2)c2ccc(cc2)Cl)nc(c1C#N)N1CCCC1
• IUPAC Name: 2-({[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-[4-(2-hydroxyethoxy)phenyl]-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile
• InChIKey: RFJKJKQQWXKVTD-UHFFFAOYSA-N
• INCHI: 1S/C29H24ClN5O2S2/c30-21-7-3-20(4-8-21)28-33-22(17-38-28)18-39-29-25(16-32)26(19-5-9-23(10-6-19)37-14-13-36)24(15-31)27(34-29)35-11-1-2-12-35/h3-10,17,36H,1-2,11-14,18H2
• 이성체 SMILES: C1CCN(C1)C2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)OCCO)C#N)SCC4=CSC(=N4)C5=CC=C(C=C5)Cl
• PubChem CID: 46847262

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Pyridines and derivatives
      • Subclass Phenylpyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Pyridines and derivatives
• Subclass: Phenylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpyridines
• Alternative Parents: 3-pyridinecarbonitriles Phenoxy compounds Phenol ethers Dialkylarylamines 2,4-disubstituted thiazoles Alkyl aryl ethers Alkylarylthioethers Aminopyridines and derivatives Chlorobenzenes Imidolactams Aryl chlorides Pyrrolidines Heteroaromatic compounds Nitriles Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organochlorides Primary alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 4-phenylpyridine - Phenol ether - Phenoxy compound - Aryl thioether - Dialkylarylamine - 3-pyridinecarbonitrile - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Aminopyridine - Chlorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Imidolactam - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Pyrrolidine - Azole - Tertiary amine - Sulfenyl compound - Azacycle - Thioether - Ether - Carbonitrile - Nitrile - Alcohol - Cyanide - Amine - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Primary alcohol - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.
• 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

관련 대상(인간)

ADORA1 Tclin Adenosine receptor A1 (0 Activities)

Discover Target: ADORA1

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

자주 묻는 질문

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 N612215. InChIKey RFJKJKQQWXKVTD-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.