Ebselen
Also known as 2-Phenyl-1,2-benzisoselenazol-3(2H)-one, 2-phenyl-1,2-benzoselenazol-3-one, Ebselene
Key facts
What buyers check first
- CAS number
- 60940-34-3
- Formula
- C13H9NOSe
- Molar mass
- 274.18 g/mol
- EC number
- 612-054-8
- HS code
- 293499
- Category
- Analgesics and anti-inflammatories
What is Ebselen?
Plain description, key identifiers and synonyms
Ebselen is a benzoselenazole that is 1,2-benzoselenazol-3-one carrying an additional phenyl substituent at position 2. Acts as a mimic of glutathione peroxidase. It has a role as an EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor, an anticoronaviral agent, a ferroptosis inhibitor, an EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitor, an antioxidant, an antibacterial agent, an anti-inflammatory drug, an antineoplastic agent, an antifungal agent, a radical scavenger, a genotoxin, an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor, a hepatoprotective agent, a neuroprotective agent, an EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor, an EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor, an apoptosis inducer, an EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor, an enzyme mimic, an EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor, an EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor, an EC 3.5.4.1 (cytosine deaminase) inhibitor and an EC 5.1.3.2 (UDP-glucose 4-epimerase) inhibitor.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2-phenyl-1,2-benzoselenazol-3-one
- CAS number
- 60940-34-3 CAS number cross-checked
- EC number
- 612-054-8
- Molecular formula
- C13H9NOSe
- UNII
- 40X2P7DPGH
- MDL number
- MFCD00210937
- InChIKey
- DYEFUKCXAQOFHX-UHFFFAOYSA-N
- InChI
- InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H
- SMILES (canonical and isomeric)
- C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3[Se]2
Synonyms
- 2-Phenyl-1,2-benzisoselenazol-3(2H)-one
- 2-phenyl-1,2-benzoselenazol-3-one
- Ebselene
- Ebseleno
- Ebselenum
- PZ 51
- 2-phenyl-1,2-benzoisoselenazol-3(2H)-one
- 2-phenyl-2,3-dihydro-1,2-benzoselenazol-3-one
- SPI 1005
- 2-phenylbenzoisoselenazol-3(2H)-one
- 2-phenylbenzo[d][1,2]selenazol-3(2H)-one
- Harmokisane
- C13H9NOSe
- 1,2-Benzisoselenazol-3(2H)-one, 2-phenyl-
- DR 3305
- 2-Phenyl-1,2-benzisoselenazolin-3-one
- 2-phenyl-1,2-benzoselenazol-3(2h)-one
- DivK1c_000951
- Bio2_000062
- Bio2_000542
- RP 60931
- 2-Phenyl-1,2-benzoselenazol-3-one (Ebselen)
- Ebselen?
- 2-Phenyl-1,2-benzoisoselenazol-3(2H)-one, CCG-39161, Ebselen, Lopac E 3520, NSC 639762, PZ 51
- Ebselen (C5)
Show all 27 synonymsShow fewer synonyms
- nchembio.109-comp1
- Ebeselen
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 274.18 g/molcalc.Computed value |
|---|---|
| Exact mass | 274.9849 Dacalc.Computed value |
| LogP (octanol/water) | 2.05calc.Computed value |
| Topological polar surface area | 22 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 1calc.Computed value |
| Heavy atoms | 16calc.Computed value |
| Rings | 3calc.Computed value |
| Aromatic rings | 3calc.Computed value |
| Fraction sp3 carbons | 0calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
O=c1c2ccccc2[se]n1-c1ccccc1
3 rings, 16 atoms. This chemical is the scaffold itself.
32 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H301Toxic if swallowed.
- H331Toxic if inhaled.
- H373May cause damage to organs through prolonged or repeated exposure.
- H400Very toxic to aquatic life.
- H410Very toxic to aquatic life with long lasting effects.
Precautionary statements (16)
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P273Avoid release to the environment.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P316Get emergency medical help immediately.
- P319Get medical help if you feel unwell.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P391Collect spillage.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidEbselen suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- Price on request
- Price on request
- Price on request
- ChinaUnclaimed profileEbselenGrade, purity and minimum order on requestPrice on request
- Price on request
- Price on request
- China, NanjingUnclaimed profileEbselenGrade, purity and minimum order on requestPrice on request
- United States, Monmouth JunctionUnclaimed profileEbselenGrade, purity and minimum order on requestPrice on request
- Price on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
70 suppliers in 12 countries
- United States27
- China26
- United Kingdom6
- Germany2
- Hong Kong2
- Belgium1
- and 6 more countries
Send one request to many suppliers
Choose up to 10 suppliers or let us match your request. Compare quotes side by side, free.
Ebselen price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Pharmacological actions
- Anti-Inflammatory Agents, Non-Steroidal
- Anti-Ulcer Agents
- Antioxidants
- Cyclooxygenase Inhibitors
- Neuroprotective Agents
Roles
- anti-inflammatory agent
- anti-inflammatory drug
- antibacterial agent
- anticoronaviral agent
- antidepressant
- antifungal agent
- antineoplastic agent
- antioxidant
- antipsychotic agent
- antiviral agent
- apoptosis inducer
- central nervous system depressant
- central nervous system drug
- enzyme mimic
- ferroptosis inhibitor
- genotoxin
- hepatoprotective agent
- hypoglycemic agent
- neuroprotective agent
- pharmaceutical
- protective agent
- psychotropic drug
- radical scavenger
- tranquilizing drug
Pharmacology
Ebselen is a organoselenium compound with anti-inflammatory, anti-oxidant and cytoprotective activity. Ebselen acts as a glutathione peroxidase mimetic and is thereby able to prevent cellular damage induced by reactive oxygen species (ROS). In addition, this agent inhibits the activity of a variety of enzymes including nitric oxide synthase (NOS), 5-lipoxygenase, cyclooxygenase, protein kinase C (PKC), NADPH oxidase and gastric H+/K+-ATPase. Furthermore, ebselen may be neuroprotective due to its ability to neutralize free radicals upon NMDA receptor activation thus, reducing lipoperoxidation mediated by glutamate-induced excitotoxicity.
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Ebselen is traded under.
Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934
- United States24.5%
- Germany23.1%
- Japan4.5%
The HS code shown for Ebselen is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Ebselen, based on the data on this page
What is Ebselen?
What is the CAS number of Ebselen?
What is the molecular formula and weight of Ebselen?
What is Ebselen used for?
Is Ebselen hazardous?
What is the HS code of Ebselen?
Where can I buy Ebselen?
What is the price of Ebselen?
Guides for buyers
Practical guides that help when you source, ship or handle Ebselen
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
Get quotes for Ebselen
Embed this structure on your websiteShow code
Paste this code into your page to show the 2D structure of Ebselen with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.
<iframe src="https://www.compoundlist.com/embed/structure/ebselen-60940-34-3" title="Ebselen structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>Explore more in Analgesics and anti-inflammatories or HS code 293499