Butenafine hydrochlorideProduct ingredient for Butenafine
- Name
- Butenafine hydrochloride
- Drug Entry
- Butenafine
Butenafine hydrochloride is a synthetic benzylamine antifungal agent. Butenafine's mechanism of action is believed to involve the synthesis inhibition of sterols. In particular, butenafine acts to inhibit the activity of the squalene epoxidase enzyme that is essential in the formation of sterols necessary for fungal cell membranes.
- Accession Number
- DBSALT000245
- Structure
- Synonyms
- Butenafine HCl
- UNII
- R8XA2029ZI
- CAS Number
- 101827-46-7
- Weight
- Average: 353.928
Monoisotopic: 353.191027608 - Chemical Formula
- C23H28ClN
- InChI Key
- LJBSAUIFGPSHCN-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H27N.ClH/c1-23(2,3)21-14-12-18(13-15-21)16-24(4)17-20-10-7-9-19-8-5-6-11-22(19)20;/h5-15H,16-17H2,1-4H3;1H
- IUPAC Name
- [(4-tert-butylphenyl)methyl](methyl)[(naphthalen-1-yl)methyl]amine hydrochloride
- SMILES
- Cl.CN(CC1=CC=C(C=C1)C(C)(C)C)CC1=CC=CC2=CC=CC=C12
- External Links
- KEGG Compound
- C12490
- PubChem Compound
- 443867
- ChemSpider
- 391957
- ChEBI
- 31325
- ChEMBL
- CHEMBL1200397
- Wikipedia
- Butenafine
- Predicted Properties
Property Value Source Water Solubility 7.56e-05 mg/mL ALOGPS logP 5.85 ALOGPS logP 6.17 Chemaxon logS -6.6 ALOGPS pKa (Strongest Basic) 9.06 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 3.24 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 104.33 m3·mol-1 Chemaxon Polarizability 38.7 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon