Perampanel hydrateProduct ingredient for Perampanel

Name
Perampanel hydrate
Drug Entry
Perampanel

Perampanel is a noncompetitive AMPA glutamate receptor antagonist. It is marketed under the name Fycompa™ and is indicated as an adjunct in patients over 12 years old for the treatment of partial-onset seizures that may or may not occur with generalized seizures. The FDA label includes an important black-boxed warning of serious or life-threatening behavioral and psychiatric reactions in patients taking Fycompa™.

Accession Number
DBSALT001824
Structure
Thumb
Synonyms
Not Available
UNII
8LIX22217M
CAS Number
1571982-04-1
Weight
Average: 1451.617
Monoisotopic: 1450.517742513
Chemical Formula
C92H66N12O7
InChI Key
PDWMJDKMSASBNE-UHFFFAOYSA-N
InChI
InChI=1S/4C23H15N3O.3H2O/c4*24-15-17-8-4-5-11-20(17)21-14-18(22-12-6-7-13-25-22)16-26(23(21)27)19-9-2-1-3-10-19;;;/h4*1-14,16H;3*1H2
IUPAC Name
tetrakis(2-{6'-oxo-1'-phenyl-1',6'-dihydro-[2,3'-bipyridine]-5'-yl}benzonitrile) trihydrate
SMILES
O.O.O.O=C1N(C=C(C=C1C1=C(C=CC=C1)C#N)C1=NC=CC=C1)C1=CC=CC=C1.O=C1N(C=C(C=C1C1=C(C=CC=C1)C#N)C1=NC=CC=C1)C1=CC=CC=C1.O=C1N(C=C(C=C1C1=C(C=CC=C1)C#N)C1=NC=CC=C1)C1=CC=CC=C1.O=C1N(C=C(C=C1C1=C(C=CC=C1)C#N)C1=NC=CC=C1)C1=CC=CC=C1
ChemSpider
28533413
ChEBI
71015
Predicted Properties
PropertyValueSource
Water Solubility0.0056 mg/mLALOGPS
logP3.54ALOGPS
logP4.11ChemAxon
logS-4.8ALOGPS
pKa (Strongest Basic)4.01ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count3ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area56.99 Å2ChemAxon
Rotatable Bond Count12ChemAxon
Refractivity104.74 m3·mol-1ChemAxon
Polarizability38.02 Å3ChemAxon
Number of Rings16ChemAxon
Bioavailability0ChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon