Econazole nitrateProduct ingredient for Econazole
- Name
- Econazole nitrate
- Drug Entry
- Econazole
A broad spectrum antimycotic with some action against Gram positive bacteria. It is used topically in dermatomycoses also orally and parenterally.
- Accession Number
- DBSALT002838
- Structure
Structure for Econazole nitrate (DBSALT002838)
- Synonyms
- Not Available
- External IDs
- R 14,827 / R-14827 / SQ 13050 / SQ-13050
- UNII
- H438WYN10E
- CAS Number
- 24169-02-6
- Weight
- Average: 444.69
Monoisotopic: 443.0206391 - Chemical Formula
- C18H16Cl3N3O4
- InChI Key
- DDXORDQKGIZAME-UHFFFAOYSA-N
- InChI
- InChI=1S/C18H15Cl3N2O.HNO3/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21;2-1(3)4/h1-9,12,18H,10-11H2;(H,2,3,4)
- IUPAC Name
- 1-{2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole; nitric acid
- SMILES
- O[N+]([O-])=O.ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C=C1
- External Links
- KEGG Compound
- C08069
- ChemSpider
- 61857
- ChEMBL
- CHEMBL1201049
- Wikipedia
- Econazole
- Predicted Properties
Property Value Source Water Solubility 0.00148 mg/mL ALOGPS logP 4.67 ALOGPS logP 5.35 Chemaxon logS -5.4 ALOGPS pKa (Strongest Basic) 6.48 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 27.05 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 98.26 m3·mol-1 Chemaxon Polarizability 37.87 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