Myristalkonium chlorideProduct ingredient for Myristalkonium

Name
Myristalkonium chloride
Drug Entry
Myristalkonium
Accession Number
DBSALT002527
Structure
Synonyms
Miristalkonium chloride
UNII
0W255OL75T
CAS Number
139-08-2
Weight
Average: 368.05
Monoisotopic: 367.3005781
Chemical Formula
C23H42ClN
InChI Key
OCBHHZMJRVXXQK-UHFFFAOYSA-M
InChI
InChI=1S/C23H42N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23;/h15-17,19-20H,4-14,18,21-22H2,1-3H3;1H/q+1;/p-1
IUPAC Name
benzyldimethyltetradecylazanium chloride
SMILES
[Cl-].CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
ChemSpider
8425
ChEMBL
CHEMBL421049
Predicted Properties
PropertyValueSource
logP3.52Chemaxon
pKa (Strongest Acidic)18.11Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count0Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area0 Å2Chemaxon
Rotatable Bond Count15Chemaxon
Refractivity120.4 m3·mol-1Chemaxon
Polarizability45.75 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon