ocedurenone - Moligand™ , Antagonist of Mineralocorticoid receptor, CAS No.1359969-24-6, Antagonist of Mineralocorticoid receptor

CAS: 1359969-24-6 Cat. No.: O612456 PubChem CID: 75593324

GRADE & PURITY Moligand™

Synonyms

1359969-24-6 | 2-Chloro-4-((3S,3aR)-3-cyclopentyl-7-((4-hydroxy-1-piperidinyl)carbonyl)-3,3a,4,5-tetrahydro-2H-pyrazolo(3,4-f)quinolin-2-yl)benzonitrile | Example 12 [US9468635B2] | GTPL12040 | AKOS040756680 | KBP5074 | KBP-5074 | Ocedurenone | Benzonitri

Storage

Room temperature

Specifications

Synonymes

1359969-24-6 | 2-Chloro-4-((3S,3aR)-3-cyclopentyl-7-((4-hydroxy-1-piperidinyl)carbonyl)-3,3a,4,5-tetrahydro-2H-pyrazolo(3,4-f)quinolin-2-yl)benzonitrile | Example 12 [US9468635B2] | GTPL12040 | AKOS040756680 | KBP5074 | KBP-5074 | Ocedurenone | Benzonitri

Spécifications et pureté

Moligand™

Conditions de stockage de stockage

Room temperature

Grade

Moligand™

Type d'action

ANTAGONIST

Mécanisme d'action

Antagonist of Mineralocorticoid receptor

Noms et identifiants

• Sourires canoniques: C1CCC(C1)[C@H]1[C@H]2CCc3c(C2=NN1c1cc(c(cc1)C#N)Cl)ccc(n3)C(=O)N1CCC(CC1)O
• IUPAC Name: 4-[(3S,3aR)-3-cyclopentyl-7-(4-hydroxypiperidine-1-carbonyl)-3,3a,4,5-tetrahydropyrazolo[3,4-f]quinolin-2-yl]-2-chlorobenzonitrile
• InChIKey: UXHQLGLGLZKHTC-CUNXSJBXSA-N
• INCHI: 1S/C28H30ClN5O2/c29-23-15-19(6-5-18(23)16-30)34-27(17-3-1-2-4-17)22-8-9-24-21(26(22)32-34)7-10-25(31-24)28(36)33-13-11-20(35)12-14-33/h5-7,10,15,17,20,22,27,35H,1-4,8-9,11-14H2/t22-,27-/m0/s1
• Isomères SMILES: C1CCC(C1)[C@H]2[C@H]3CCC4=C(C3=NN2C5=CC(=C(C=C5)C#N)Cl)C=CC(=N4)C(=O)N6CCC(CC6)O
• PubChem CID: 75593324

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Quinolines and derivatives
      • Subclass Quinoline carboxamides

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Quinolines and derivatives
• Subclass: Quinoline carboxamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinoline carboxamides
• Alternative Parents: Pyridinecarboxylic acids and derivatives N-acylpiperidines Polyhalopyridines Benzonitriles Hydroxypyridines Chlorobenzenes 2-halopyridines N-acyl amines Tertiary carboxylic acid amides Secondary ketimines Pyrazolines Heteroaromatic compounds Secondary alcohols Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Nitriles Hydrazones Chloroalkenes Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoline-2-carboxamide - Pyridine carboxylic acid or derivatives - N-acyl-piperidine - Polyhalopyridine - Benzonitrile - 2-halopyridine - Hydroxypyridine - Halobenzene - Chlorobenzene - Benzenoid - Pyridine - Piperidine - N-acyl-amine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary ketimine - Pyrazoline - Secondary alcohol - Ketimine - Carboxamide group - Azacycle - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl chloride - Nitrile - Carbonitrile - Hydrazone - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Imine - Alcohol - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as quinoline carboxamides. These are quinolines in which the quinoline ring system is substituted by one or more carboxamide 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

Cibles associées (humaines)

NR3C2 Tclin Mineralocorticoid receptor (0 Activities)

Discover Target: NR3C2

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

Foire aux questions

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 1359969-24-6. InChIKey UXHQLGLGLZKHTC-CUNXSJBXSA-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.