Cppha

Base Information

• Chemical Name: Cppha
• CAS No.: 693288-97-0
• Molecular Formula: C22H15ClN2O4
• Molecular Weight: 407
• Hs Code.: 2925190090
• European Community (EC) Number: 686-980-6
• DSSTox Substance ID: DTXSID80433014
• Nikkaji Number: J3.353.515E
• Wikidata: Q27076912
• Pharos Ligand ID: 1MFW5FM9G8N3
• ChEMBL ID: CHEMBL366217
• Mol file: 693288-97-0.mol

Synonyms:CPPHA cpd;N-(4-chloro-2-((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl)phenyl)-2-hydroxybenzamide

Chemical Property of Cppha

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 539.7°C at 760 mmHg
• PKA: 8.24±0.30(Predicted)
• Flash Point: 280.201°C
• PSA: 86.71000
• Density: 1.505
• LogP: 4.10500
• Storage Temp.: ?20°C
• Solubility.: DMSO: >20mg/mL
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 406.0720347
• Heavy Atom Count: 29
• Complexity: 633

Purity/Quality:

97% ^*data from raw suppliers

CPPHA ^*data from reagent suppliers

Safty Information:

• Hazard Codes: N
• Statements: 50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C(C=CC(=C3)Cl)NC(=O)C4=CC=CC=C4O
• Description: CPPHA is a positive allosteric modulator of metabotropic glutamate receptor 5 (mGluR5) that potentiates human and rat mGluR5 activation by glutamate, 3,5-DHPG , and quisqualate (EC50s = 0.316-0.5 and 0.634-1.16 μM for human and rat mGluR5, respectively). It is selective for mGluR5 over other mGluRs but exhibits submicromolar activity at PDE6, δ- and κ-opioid receptors, and the ether-a-go-go related gene (ERG) potassium channel (Kis = 500, 352, 474, and 813 nM, respectively). CPPHA potentiates 3,5-DHPG-induced NMDA currents in CA1 pyramidal cells and the depolarization of rat subthalamic nucleus (STN) neurons.

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