Tioconazole hydrochlorideProduct ingredient for Tioconazole
- Name
- Tioconazole hydrochloride
- Drug Entry
- Tioconazole
Tioconazole is an imidazole antifungal used to treat fungal and yeast infections. Topical formulations are used for ringworm, jock itch, athlete's foot, and tinea versicolor or "sun fungus". Tioconazole interacts with 14-alpha demethylase, a cytochrome P-450 enzyme that converts lanosterol to ergosterol, an essential component of the yeast membrane. In this way, tioconazole inhibits ergosterol synthesis, resulting in increased cellular permeability. In addition to being an antifungal, tioconazole also has antibacterial effects on certain Gram-positive cocci bacteria.1
- Accession Number
- DBSALT002308
- Structure
Structure for Tioconazole hydrochloride (DBSALT002308)
- Synonyms
- Not Available
- UNII
- T1QKM21KYB
- CAS Number
- 61675-64-7
- Weight
- Average: 424.16
Monoisotopic: 421.9580951 - Chemical Formula
- C16H14Cl4N2OS
- InChI Key
- UKQXXGSDDSCAHA-UHFFFAOYSA-N
- InChI
- InChI=1S/C16H13Cl3N2OS.ClH/c17-12-1-2-13(14(18)7-12)15(8-21-5-4-20-10-21)22-9-11-3-6-23-16(11)19;/h1-7,10,15H,8-9H2;1H
- IUPAC Name
- 1-{2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole hydrochloride
- SMILES
- Cl.ClC1=C(COC(CN2C=CN=C2)C2=C(Cl)C=C(Cl)C=C2)C=CS1
- External Links
- ChemSpider
- 13303881
- Predicted Properties
Property Value Source Water Solubility 0.0165 mg/mL ALOGPS logP 4.86 ALOGPS logP 5.3 Chemaxon logS -4.4 ALOGPS pKa (Strongest Basic) 6.77 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 27.05 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 94.53 m3·mol-1 Chemaxon Polarizability 37.2 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