Identification
- Summary
Didecyldimethylammonium is a disinfectant and microbicidal agent used in a variety of products.
- Generic Name
- Didecyldimethylammonium
- DrugBank Accession Number
- DB04221
- Background
Not Available
- Type
- Small Molecule
- Groups
- Approved, Experimental
- Structure
Structure for Didecyldimethylammonium (DB04221)
- Weight
- Average: 326.6232
Monoisotopic: 326.378675541 - Chemical Formula
- C22H48N
- Synonyms
- Didecyl-dimethyl-ammonium
- Didecyldimethylammonium cation
- Didecyldimethylammonium ion
- Didecyldimonium
Pharmacology
- Indication
Not Available
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- Contraindications & Blackbox Warnings
Prevent Adverse Drug Events TodayTap into our Clinical API for life-saving information on contraindications & blackbox warnings, population restrictions, harmful risks, & more.Avoid life-threatening adverse drug events with our Clinical API- Pharmacodynamics
Not Available
- Mechanism of action
Target Actions Organism UPhospholipid membrane Not Available Escherichia coli (strain K12) UCyclopropane mycolic acid synthase 2 Not Available Mycobacterium tuberculosis - Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.Not Available
- Food Interactions
- No interactions found.
Products
Drug product information from 10+ global regionsOur datasets provide approved product information including:dosage, form, labeller, route of administration, and marketing period.Access drug product information from over 10 global regions.- Product Ingredients
Ingredient UNII CAS InChI Key Didecyldimethylammonium chloride JXN40O9Y9B 7173-51-5 RUPBZQFQVRMKDG-UHFFFAOYSA-M - Over the Counter Products
Name Dosage Strength Route Labeller Marketing Start Marketing End Region Image Chloroqcare Antiseptic Hand Care Liquid 117 mg/60mL Topical Wartkang Medical Technology Co., Ltd 2021-11-10 Not applicable US 
Hand Sanitizing Wipes Cloth 0.15 1/1001 Topical Shandong BaiHe Sanitary Products Co., Ltd. 2020-11-23 Not applicable US MEOLY Milia Remover Serum Liquid 0.025 g/100g Topical Consilii LLC 2023-08-14 Not applicable US Milia Remover Serum Liquid 0.025 g/100g Topical Consilii LLC 2023-08-14 Not applicable US OKGO Disinfectant Spray 0.5 mg/1mL Topical Henan Seagood Medical Equipment Co., Ltd. 2021-01-26 Not applicable US - Mixture Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image (Aenc) Disinfectant WATER-FREE HAND FOAM Didecyldimethylammonium chloride (0.11 mg/100mL) + Polihexanide (0.56 mg/100mL) Solution Topical Yantai Dongke Lvzhiyuan Disinfection Pharmaceutical Co., Ltd. 2020-05-20 2021-11-23 US 30 Soft Wipes Didecyldimethylammonium chloride (0.15 g/100g) + Benzalkonium chloride (0.1 g/100g) Cloth Topical SHANGHAI SANJUN GENERAL MERCHANDISE CO., LTD. 2022-12-08 Not applicable US 60 Soft Wipes Didecyldimethylammonium chloride (0.15 g/100g) + Benzalkonium chloride (0.1 g/100g) Cloth Topical SHANGHAI SANJUN GENERAL MERCHANDISE CO., LTD. 2022-12-08 Not applicable US Alcohol Wet Tissue Didecyldimethylammonium chloride (0.1 g/100g) + Benzalkonium chloride (0.1 g/100g) + Cetylpyridinium chloride (0.05 g/100g) + Chlorphenesin (0.05 g/100g) + Ethanol (75 g/100g) Swab Topical SHANDONG PROVINCE RUNHE SANITARY MATERIALS CO.,LTD. 2020-04-13 Not applicable US Alcohol Wet Wipes Didecyldimethylammonium chloride (0.624 g/100g) + Benzalkonium chloride (0.624 g/100g) + Ethanol (30 g/100g) Swab Topical SHANDONG PROVINCE RUNHE SANITARY MATERIALS CO.,LTD. 2020-04-13 Not applicable US - Unapproved/Other Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image (Aenc) Disinfectant WATER-FREE HAND FOAM Didecyldimethylammonium chloride (0.11 mg/100mL) + Polihexanide (0.56 mg/100mL) Solution Topical Yantai Dongke Lvzhiyuan Disinfection Pharmaceutical Co., Ltd. 2020-05-20 2021-11-23 US Alcohol Wet Wipes Didecyldimethylammonium chloride (0.624 g/100g) + Benzalkonium chloride (0.624 g/100g) + Ethanol (30 g/100g) Swab Topical SHANDONG PROVINCE RUNHE SANITARY MATERIALS CO.,LTD. 2020-04-13 Not applicable US Alcohol Wipes Didecyldimethylammonium chloride (0.188 g/501) + Benzalkonium chloride (0.188 g/501) + Ethanol (40 mL/501) Cloth Extracorporeal Hangzhou Lin'an Sanxin Cleaning Products Co.,Ltd. 2020-05-11 Not applicable US Antibacterial Wet Wipes Didecyldimethylammonium chloride (0.012 g/100g) + Benzalkonium chloride (0.156 g/100g) + Bronopol (0.061 g/100g) + Iodopropynyl butylcarbamate (0.077 g/100g) Swab Topical SHANDONG PROVINCE RUNHE SANITARY MATERIALS CO.,LTD. 2020-04-13 Not applicable US Chloroqcare Antiseptic Hand Care Didecyldimethylammonium chloride (117 mg/60mL) Liquid Topical Wartkang Medical Technology Co., Ltd 2021-11-10 Not applicable US
Categories
- ATC Codes
- D08AJ06 — Didecyldimethylammonium chloride
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
- Kingdom
- Organic compounds
- Super Class
- Organic nitrogen compounds
- Class
- Organonitrogen compounds
- Sub Class
- Quaternary ammonium salts
- Direct Parent
- Tetraalkylammonium salts
- Alternative Parents
- Organopnictogen compounds / Organic salts / Hydrocarbon derivatives / Amines / Organic cations
- Substituents
- Aliphatic acyclic compound / Amine / Hydrocarbon derivative / Organic cation / Organic salt / Organopnictogen compound / Tetraalkylammonium salt
- Molecular Framework
- Aliphatic acyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- Z7F472XQPA
- CAS number
- 20256-56-8
- InChI Key
- JGFDZZLUDWMUQH-UHFFFAOYSA-N
- InChI
- InChI=1S/C22H48N/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2/h5-22H2,1-4H3/q+1
- IUPAC Name
- bis(decyl)dimethylazanium
- SMILES
- CCCCCCCCCC[N+](C)(C)CCCCCCCCCC
References
- General References
- Not Available
- External Links
- PubChem Compound
- 16958
- PubChem Substance
- 46504890
- ChemSpider
- 16067
- 1425983
- ChEMBL
- CHEMBL1182247
- ZINC
- ZINC000014881137
- PDBe Ligand
- 10A
- Wikipedia
- Didecyldimethylammonium_chloride
- PDB Entries
- 1kph / 1kpi
Clinical Trials
- Clinical Trials
Phase Status Purpose Conditions Count 3 Active Not Recruiting Treatment Breast Cancer 1 1, 2 Recruiting Treatment Cancer Related Cognitive Decline / Non Metastatic Breast Cancer 1
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
Form Route Strength Solution Topical Swab Topical Cloth Extracorporeal Patch Topical Solution, concentrate Vaginal 1 G/100ML Gel Topical Liquid Topical 117 mg/60mL Solution Topical 0.175 % Solution Topical 0175 % Aerosol, spray Topical Cloth Topical 0.15 1/1001 Liquid Topical Liquid Topical 0.025 g/100g Spray Topical 0.5 mg/1mL Cloth Topical Gel Topical 0.2 g/100mL Lotion Topical Spray Topical Soap Topical Liquid Extracorporeal 1 mg/500mL Spray Topical 0.2 g/100mL - Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Solid
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 3.91e-06 mg/mL ALOGPS logP 4.54 ALOGPS logP 4.01 Chemaxon logS -8 ALOGPS Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 18 Chemaxon Refractivity 118.86 m3·mol-1 Chemaxon Polarizability 47.15 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
Property Value Probability Human Intestinal Absorption - 0.9316 Blood Brain Barrier + 0.9507 Caco-2 permeable + 0.7072 P-glycoprotein substrate Substrate 0.5383 P-glycoprotein inhibitor I Non-inhibitor 0.9627 P-glycoprotein inhibitor II Non-inhibitor 0.801 Renal organic cation transporter Non-inhibitor 0.5818 CYP450 2C9 substrate Non-substrate 0.8615 CYP450 2D6 substrate Non-substrate 0.6827 CYP450 3A4 substrate Non-substrate 0.5266 CYP450 1A2 substrate Non-inhibitor 0.8361 CYP450 2C9 inhibitor Non-inhibitor 0.9569 CYP450 2D6 inhibitor Non-inhibitor 0.9235 CYP450 2C19 inhibitor Non-inhibitor 0.9237 CYP450 3A4 inhibitor Non-inhibitor 0.9896 CYP450 inhibitory promiscuity Low CYP Inhibitory Promiscuity 0.9795 Ames test Non AMES toxic 0.9608 Carcinogenicity Carcinogens 0.7426 Biodegradation Ready biodegradable 0.6956 Rat acute toxicity 2.8056 LD50, mol/kg Not applicable hERG inhibition (predictor I) Weak inhibitor 0.7692 hERG inhibition (predictor II) Inhibitor 0.5
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted GC-MS Spectrum - GC-MS Predicted GC-MS splash10-000t-3590000000-4b763bd5ad2a681a2c81 Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 194.06784 predictedDeepCCS 1.0 (2019) [M+H]+ 196.42583 predictedDeepCCS 1.0 (2019) [M+Na]+ 202.51897 predictedDeepCCS 1.0 (2019)
Targets
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1. Phospholipid membrane
Unknown
References
- Yoshimatsu T, Hiyama K: Mechanism of the action of didecyldimethylammonium chloride (DDAC) against Escherichia coil and morphological changes of the cells. Biocontrol Sci. 2007 Sep;12(3):93-9. doi: 10.4265/bio.12.93. [Article]
- Lin W, Yuan D, Deng Z, Niu B, Chen Q: The cellular and molecular mechanism of glutaraldehyde-didecyldimethylammonium bromide as a disinfectant against Candida albicans. J Appl Microbiol. 2019 Jan;126(1):102-112. doi: 10.1111/jam.14142. Epub 2018 Nov 21. [Article]
- Kind
- Protein
- Organism
- Mycobacterium tuberculosis
- Pharmacological action
- Unknown
- General Function
- Catalyzes the formation of trans cyclopropanated ketomycolate or methoxymycolate through the conversion of a double bond to a cyclopropane ring at the proximal position of an oxygenated mycolic acid via the transfer of a methylene group from S-adenosyl-L-methionine. In the absence of MmaA2, CmaA2 has a non-specific cis-cyclopropanating activity and is able to catalyze the conversion of a double bond to a cis cyclopropane ring at the distal position of an alpha mycolic acid. Cyclopropanated mycolic acids are key factors participating in cell envelope permeability, host immunomodulation and persistence.
- Specific Function
- Cyclopropane-fatty-acyl-phospholipid synthase activity
- Gene Name
- cmaA2
- Uniprot ID
- P9WPB5
- Uniprot Name
- Cyclopropane mycolic acid synthase 2
- Molecular Weight
- 34659.795 Da
Drug created at June 13, 2005 13:24 / Updated at September 28, 2021 21:54