SPP1 - Moligand™ , Agonist of M 1 receptor, CAS No.S613679, Agonist of M 1 receptor

CAS: S613679 Cat. No.: S613679 PubChem CID: 137553163

GRADE & PURITY Moligand™

Synonyms

spiropiperidine 1

Storage

Room temperature

Specifications

Synonyms

spiropiperidine 1

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of M 1 receptor

Names and Identifiers

• Canonical Smiles: Cc1cccc(c1)N1CN(C(=O)C21CCN(CC2)C1CCN(CC1)C(=O)OC1CC1)C
• IUPAC Name: cyclopropyl 4-[3-methyl-1-(3-methylphenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]piperidine-1-carboxylate
• InChIKey: ZZZVRFJGTJAHFM-UHFFFAOYSA-N
• INCHI: 1S/C24H34N4O3/c1-18-4-3-5-20(16-18)28-17-25(2)22(29)24(28)10-14-26(15-11-24)19-8-12-27(13-9-19)23(30)31-21-6-7-21/h3-5,16,19,21H,6-15,17H2,1-2H3
• PubChem CID: 137553163

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azolidines
      • Subclass Imidazolidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azolidines
• Subclass: Imidazolidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylimidazolidines
• Alternative Parents: Azaspirodecane derivatives Alpha amino acids and derivatives Piperidinecarboxylic acids Dialkylarylamines Aniline and substituted anilines Toluenes Aminopiperidines Imidazolidinones Tertiary carboxylic acid amides Carbamate esters Trialkylamines Organic carbonic acids and derivatives Lactams Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenylimidazolidine - Azaspirodecane - Alpha-amino acid or derivatives - Piperidinecarboxylic acid - Aniline or substituted anilines - Dialkylarylamine - Toluene - 4-aminopiperidine - Benzenoid - Piperidine - Imidazolidinone - Monocyclic benzene moiety - Carbamic acid ester - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carbonic acid derivative - Lactam - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylimidazolidines. These are polycyclic compounds containing an imidazoline substituted by a phenyl 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

Associated Targets(Human)

CHRM1 Tclin Muscarinic acetylcholine receptor M1 (0 Activities)

Discover Target: CHRM1

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