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Sulfiram

Alias: NSC-36731; NSC 36731; Sulfiram
Cat No.:V15487 Purity: ≥98%
Sulfiram is an exogenous antiseptic used in scabies research.
Sulfiram
Sulfiram Chemical Structure CAS No.: 95-05-6
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
50mg
100mg
Other Sizes
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Product Description
Sulfiram is an exogenous antiseptic used in scabies research.
Sulfiram (CAS# 95-05-6) is an ectoparasiticide used topically to treat scabies. It functions primarily as a weak inhibitor of aldehyde dehydrogenase (ALDH). Sulfiram is also used as a chelating agent in rubber manufacturing. It has shown potential in cancer research due to its ability to inhibit ALDH, disrupting cellular processes in certain cancer cells. Its molecular weight is 264.47 and molecular formula is C10H20N2S3.
Biological Activity I Assay Protocols (From Reference)
Targets
Sulfiram is a weak aldehyde dehydrogenase (ALDH) inhibitor. It also functions as an ectoparasiticide targeting Sarcoptes scabiei, the mite that causes scabies. Sulfiram has been investigated for its potential anticancer properties and as an adjunct treatment in certain cancers due to its ability to chelate copper ions, which are involved in tumor progression.
ln Vitro
Sulfiram exhibits antifungal and antibacterial activities. It inhibits aldehyde dehydrogenase activity, although it is considered a weak inhibitor. As an ectoparasiticide, it is effective against Sarcoptes scabiei, the scabies mite. Its ability to chelate metal ions, particularly copper, contributes to its potential anticancer properties. Specific IC50 values against ALDH or parasites are not extensively detailed.
ln Vivo
Sulfiram is applied topically to treat scabies in both humans and domestic animals. In vivo efficacy has been demonstrated in patients with scabies infestations. As an ALDH inhibitor, it has been studied for its potential in alcohol dependence and as an adjunct in cancer therapy. Specific animal model data are not extensively detailed in standard reference sources.
Enzyme Assay
Sulfiram's inhibition of aldehyde dehydrogenase (ALDH) can be assessed using in vitro enzyme activity assays. ALDH enzyme is incubated with its substrate (e.g., acetaldehyde) and NAD+ in the presence of varying concentrations of sulfiram. The production of NADH is measured spectrophotometrically at 340 nm to determine enzyme activity. The IC50 value for ALDH inhibition is calculated from dose-response curves. For studying its anti-parasitic activity, in vitro assays using Sarcoptes scabiei mites can be performed.
Cell Assay
Sulfiram's anti-parasitic activity can be evaluated in vitro using Sarcoptes scabiei mites collected from infected animals or humans. Mites are incubated in culture media containing various concentrations of sulfiram, and mite survival is monitored over time. The concentration required to kill 50% of the mites (LC50) is determined. For studying its anticancer properties, cancer cell lines can be treated with sulfiram and cell viability assessed using MTT or CellTiter-Glo assays. ALDH activity in treated cells can be measured using ALDH activity assays.
Animal Protocol
Sulfiram is typically applied topically for the treatment of scabies. In animal models of scabies, such as pigs or dogs naturally infested with Sarcoptes scabiei, sulfiram is applied topically as a lotion or ointment. The treatment is usually repeated weekly. Efficacy is assessed by skin scrapings to count live mites and by monitoring clinical signs such as pruritus and skin lesions. For other indications (e.g., cancer), oral or intraperitoneal administration in mouse models may be used.
ADME/Pharmacokinetics
Sulfiram has a molecular weight of 264.47 and is typically a viscous, light yellow liquid. Its purity is typically ≥96%. Specific pharmacokinetic parameters such as absorption, distribution, metabolism, and excretion are not extensively detailed in standard reference sources. Topical application suggests limited systemic absorption.
Toxicity/Toxicokinetics
Sulfiram is generally well-tolerated when applied topically for the treatment of scabies. It is a weak ALDH inhibitor, and its toxicity profile is less severe than that of disulfiram, which is a more potent ALDH inhibitor used for alcohol aversion therapy. Specific LD50 values and organ-specific toxicity data are not extensively detailed in standard reference sources.
References

[1]. Photolysis of sulfiram: a mechanism for its disulfiram-like reaction. Biochem Pharmacol. 1994 Nov 16;48(10):1917-25.

Additional Infomation
Sulfiram are organic sulfur compounds.
Sulfiram (CAS# 95-05-6) is also known as monosulfiram. Its primary application has been targeted at Sarcoptes scabiei infestations in both humans and domestic animals. Sulfiram has also been investigated for its potential anticancer properties and as an adjunct treatment in certain cancers. Its ability to chelate copper ions is relevant to its potential in cancer research.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C10H20N2S3
Molecular Weight
264.46
Exact Mass
264.079
CAS #
95-05-6
PubChem CID
7215
Appearance
Light yellow to yellow viscous liquid
Density
1.139g/cm3
Boiling Point
329.1ºC at 760mmHg
Flash Point
152.8ºC
Index of Refraction
1.59
LogP
2.973
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
6
Heavy Atom Count
15
Complexity
189
Defined Atom Stereocenter Count
0
SMILES
CCN(CC)C(=S)SC(=S)N(CC)CC
InChi Key
CTPKSRZFJSJGML-UHFFFAOYSA-N
InChi Code
InChI=1S/C10H20N2S3/c1-5-11(6-2)9(13)15-10(14)12(7-3)8-4/h5-8H2,1-4H3
Chemical Name
diethylcarbamothioyl N,N-diethylcarbamodithioate
Synonyms
NSC-36731; NSC 36731; Sulfiram
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.7813 mL 18.9065 mL 37.8129 mL
5 mM 0.7563 mL 3.7813 mL 7.5626 mL
10 mM 0.3781 mL 1.8906 mL 3.7813 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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