Amodiaquine hydrochlorideProduct ingredient for Amodiaquine
- Name
- Amodiaquine hydrochloride
- Drug Entry
- Amodiaquine
A 4-aminoquinoquinoline compound with anti-inflammatory properties.
- Accession Number
- DBSALT000647
- Structure
Structure for Amodiaquine hydrochloride (DBSALT000647)
- Synonyms
- Amodiaquine HCl
- UNII
- HOE64181MP
- CAS Number
- 69-44-3
- Weight
- Average: 428.783
Monoisotopic: 427.098495526 - Chemical Formula
- C20H24Cl3N3O
- InChI Key
- ROEBJVHPINPMKL-UHFFFAOYSA-N
- InChI
- InChI=1S/C20H22ClN3O.2ClH/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19;;/h5-12,25H,3-4,13H2,1-2H3,(H,22,23);2*1H
- IUPAC Name
- 4-[(7-chloroquinolin-4-yl)amino]-2-[(diethylamino)methyl]phenol dihydrochloride
- SMILES
- Cl.Cl.CCN(CC)CC1=CC(NC2=C3C=CC(Cl)=CC3=NC=C2)=CC=C1O
- External Links
- PubChem Compound
- 6246
- ChemSpider
- 6010
- ChEMBL
- CHEMBL3137745
- Wikipedia
- Amodiaquine
- Predicted Properties
Property Value Source Water Solubility 0.0088 mg/mL ALOGPS logP 4.83 ALOGPS logP 3.8 Chemaxon logS -4.6 ALOGPS pKa (Strongest Acidic) 9.1 Chemaxon pKa (Strongest Basic) 10.17 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 48.39 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 103.29 m3·mol-1 Chemaxon Polarizability 39.4 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon