PF-07038124 - Moligand™ , Inhibitor of phosphodiesterase 4B, CAS No.P612749, Inhibitor of phosphodiesterase 4B

CAS: P612749 Cat. No.: P612749 PubChem CID: 148293990

GRADE & PURITY Moligand™

Synonyms

GTPL11950 | (R)-4-(5-(4-Methoxy-3-propoxyphenyl)pyridin-3-yl)-1,2-oxaborolan-2-ol | M6ZU548FWD | US11559538, Example 4 | HY-144683 | PF 07038124 [WHO-DD] | 3-[(4R)-2-hydroxyoxaborolan-4-yl]-5-(4-methoxy-3-propoxyphenyl)pyridine | Pyridine, 3-((4R)-2-hydro

Storage

Room temperature

Specifications

Synonyms

GTPL11950 | (R)-4-(5-(4-Methoxy-3-propoxyphenyl)pyridin-3-yl)-1, 2-oxaborolan-2-ol | M6ZU548FWD | US11559538, Example 4 | HY-144683 | PF 07038124 [WHO-DD] | 3-[(4R)-2-hydroxyoxaborolan-4-yl]-5-(4-methoxy-3-propoxyphenyl)pyridine | Pyridine, 3-((4R)-2-hydro

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of phosphodiesterase 4B

Names and Identifiers

• Canonical Smiles: CCCOc1cc(ccc1OC)c1cncc(c1)[C@@H]1COB(O)C1
• IUPAC Name: 3-[(4R)-2-hydroxyoxaborolan-4-yl]-5-(4-methoxy-3-propoxyphenyl)pyridine
• InChIKey: KXVKOYCGACSUPP-INIZCTEOSA-N
• INCHI: 1S/C18H22BNO4/c1-3-6-23-18-8-13(4-5-17(18)22-2)14-7-15(11-20-10-14)16-9-19(21)24-12-16/h4-5,7-8,10-11,16,21H,3,6,9,12H2,1-2H3/t16-/m0/s1
• Isomeric SMILES: B1(C[C@@H](CO1)C2=CN=CC(=C2)C3=CC(=C(C=C3)OC)OCCC)O
• PubChem CID: 148293990

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Phenylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpyridines
• Alternative Parents: Phenoxy compounds Methoxybenzenes Anisoles Methylpyridines Hydroxypyridines Alkyl aryl ethers Oxaborole derivatives Heteroaromatic compounds Boronic acid esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic metalloid salts Azacyclic compounds Aldimines Organopnictogen compounds Organoboron compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 3-phenylpyridine - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Methylpyridine - Hydroxypyridine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - 1,2-oxaborole derivative - Boronic acid ester - Boronic acid derivative - Oxacycle - Azacycle - Organic metalloid salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Aldimine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Organoboron compound - Imine - Aromatic heteromonocyclic compound
• Description: 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

Associated Targets(Human)

PDE4B Tclin cAMP-specific 3',5'-cyclic phosphodiesterase 4B (0 Activities)

Discover Target: PDE4B

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