Quinacrine dihydrochlorideProduct ingredient for Quinacrine
- Name
- Quinacrine dihydrochloride
- Drug Entry
- Quinacrine
An acridine derivative formerly widely used as an antimalarial but superseded by chloroquine in recent years. It has also been used as an anthelmintic and in the treatment of giardiasis and malignant effusions. It is used in cell biological experiments as an inhibitor of phospholipase A2.
- Accession Number
- DBSALT002200
- Structure
Structure for Quinacrine dihydrochloride (DBSALT002200)
- Synonyms
- Anhydrous mepacrine dihydrochloride / Mepacrine hydrochloride anhydrous / Quinacrine hydrochloride anhydrous
- UNII
- 81A613ZZ6X
- CAS Number
- 69-05-6
- Weight
- Average: 472.879
Monoisotopic: 471.161095782 - Chemical Formula
- C23H32Cl3N3O
- InChI Key
- UDKVBVICMUEIKS-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H30ClN3O.2ClH/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23;;/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26);2*1H
- IUPAC Name
- 6-chloro-N-[5-(diethylamino)pentan-2-yl]-2-methoxyacridin-9-amine dihydrochloride
- SMILES
- Cl.Cl.CCN(CC)CCCC(C)NC1=C2C=C(OC)C=CC2=NC2=C1C=CC(Cl)=C2
- External Links
- ChemSpider
- 6003
- ChEMBL
- CHEMBL554190
- Predicted Properties
Property Value Source Water Solubility 0.00239 mg/mL ALOGPS logP 6.13 ALOGPS logP 5.15 Chemaxon logS -5.2 ALOGPS pKa (Strongest Basic) 10.33 Chemaxon Physiological Charge 2 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 37.39 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 118.96 m3·mol-1 Chemaxon Polarizability 46.31 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule Yes Chemaxon