Products for Research Use Only

Tioconazole

CAT: 0013-GTR19176419-03Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19176419-03Size:500 mg
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Description
Tioconazole is an imidazole antifungal agent that disrupts fungal cell membrane integrity by inhibiting ergosterol biosynthesis. It is widely used in research for studying antifungal mechanisms and efficacy in both in vitro assays and in vivo models of fungal infection.
CAS Number
65899-73-2
Product Name Alternative
14-α Demethylase, antimicrobial, antifungal, Antibiotic, Inhibitor, Fungal, inhibit, mycoses, infections, Tioconazole, superficial, yeast, UK 20349, UK20349, UK-20349, Vagistat
Field of Research
Cell Biology, Infectious Disease & Virology, Pharmacology & Drug Discovery, Signal Transduction
Purity
98.56% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.16 mM) ; H2O:< 1 mg/mL (insoluble or slightly soluble) ; Ethanol:72 mg/mL (185.71 mM) ; DMSO:50 mg/mL (128.96 mM)
Smiles
C (CN1C=CN=C1) (OCC2=C (Cl) SC=C2) C3=C (Cl) C=C (Cl) C=C3
Molecular Formula
C16H13Cl3N2OS
Molecular Weight
387.71
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tioconazole

1-{2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}imidazole is a member of the class of imidazoles that comprises 2-(2,4-dichlorophenyl)ethylimidazole carrying an additional (2-chloro-3-thienyl)methoxy substituent at position 2. It is a dichlorobenzene, a member of imidazoles, an ether and a member of thiophenes.

CAS Number65899-73-2
PubChem CID5482
IUPAC Name1-[2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
Molecular FormulaC16H13Cl3N2OS
Molecular Weight387.7
XLogP5.3
Topological Polar Surface Area55.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity379
SMILES
C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)OCC3=C(SC=C3)Cl
InChI
InChI=1S/C16H13Cl3N2OS/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
InChIKey
QXHHHPZILQDDPS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tioconazole
CAS: 65899-73-2
CID: 5482
Formula: C16H13Cl3N2OS
MW: 387.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight387.7
XLogP35.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass385.981417
Monoisotopic Mass385.981417
Topological Polar Surface Area55.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity379
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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