Ibudilast
Also known as Ketas, Ibudilastum, 2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
Key facts
What buyers check first
- CAS number
- 50847-11-5
- Formula
- C14H18N2O
- Molar mass
- 230.31 g/mol
- EC number
- 637-150-7
- HS code
- 293399
- Category
- Heterocyclic building blocks
What is Ibudilast?
Plain description, key identifiers and synonyms
Ibudilast is a pyrazolopyridine.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
- CAS number
- 50847-11-5 CAS number cross-checked
- EC number
- 637-150-7
- Molecular formula
- C14H18N2O
- UNII
- M0TTH61XC5
- MDL number
- MFCD00864808
- InChIKey
- ZJVFLBOZORBYFE-UHFFFAOYSA-N
- InChI
- InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3
- SMILES (canonical and isomeric)
- CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C
Synonyms
- Ketas
- Ibudilastum
- 2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
- 3-Isobutyryl-2-isopropylpyrazolo[1,5-a]pyridine
- 3-Isobutyryl-2-isopropylpyrazolo(1,5-a)pyridine
- AV 411
- 1-(2-Isopropylpyrazolo(1,5-a)pyridin-3-yl)-2-methyl-1-propanone
- 2-methyl-1-(2-propan-2-ylpyrazolo(1,5-a)pyridin-3-yl)propan-1-one
- 1-(2-isopropylpyrazolo(1,5-alpha)pyridin-3-yl)-2-methyl-1-propanone
- 1-(2-(1-Methylethyl)pyrazolo(1,5-a)pyridin-3-yl)-2-methylpropan-1-one
- Ke Tas
- Eyevinal
- 1-(2-isopropylpyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one
- Ketas (TN)
- Tocris-1694
- 1-Propanone, 2-methyl-1-[2-(1-methylethyl)pyrazolo[1,5-a]pyridin-3-yl]-
- 2-Isopropyl-3-isobutyrylpyrazolo(1,5-a)pyridine
- 2-Methyl-1-[2-(Propan-2-Yl)pyrazolo[1,5-A]pyridin-3-Yl]propan-1-One
- 2-methyl-1-[2-(1-methylethyl)pyrazolo[1,5-a]pyridin-3-yl]-1-propanone
- KC-404, AV-411, MN-166
- 2-isopropyl-3-isobutyrylpyrazolo[1,5-a]pyridine
- 1-Propanone, 2-methyl-1-(2-(1-methylethyl)pyrazolo(1,5-a)pyridin-3-yl)-
- Pinatos
- Ibudilast (JAN/INN)
- Ibudilast?
Show all 31 synonymsShow fewer synonyms
- Pyrazolo(1,5-a)pyridine, 3-isobutyryl-2-isopropyl-
- Ibudilast (Standard)
- 1-(2-Isopr
- Ibudilast (JP17/INN)
- Ibudilast (JP18/INN)
- 5-24-03-00396 (Beilstein Handbook Reference)
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 | 230.31 g/molcalc.Computed value |
|---|---|
| Exact mass | 230.1419 Dacalc.Computed value |
| LogP (octanol/water) | 3.3calc.Computed value |
| Topological polar surface area | 34.37 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 2calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 17calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.43calc.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
c1ccn2nccc2c1
2 rings, 9 atoms, the Pyrazolo(1,5-a)pyridine ring system.
1,603 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
- H315Causes skin irritation.
- H319Causes serious eye irritation.
- H335May cause respiratory irritation.
Precautionary statements (19)
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P317If swallowed: Get medical help.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P319Get medical help if you feel unwell.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P332 + P317If skin irritation occurs: Get medical help.
- P337 + P317If eye irritation persists: Get medical help.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- 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 aidIbudilast suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- China, Wuxi ManufacturerUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- China, ShanghaiUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- China, JinanUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- Japan ManufacturerUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- Japan, Ashikaga ManufacturerUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- Japan, Chuo ManufacturerUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- United States, HaywardUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- United States, Redwood CityUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- GermanyUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice on request
- China, ShanghaiUnclaimed profileIbudilastGrade, purity and minimum order on requestPrice 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
30 suppliers in 6 countries
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Ibudilast price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Industries and functions
Pharmacological actions
- Bronchodilator Agents
- Phosphodiesterase Inhibitors
- Platelet Aggregation Inhibitors
- Vasodilator Agents
Roles
- analgesic
- anticoronaviral agent
- antimicrobial agent
- antineoplastic agent
- antiviral agent
- immunomodulator
- immunosuppressive agent
- pharmaceutical
Pharmacology
Ibudilast is an orally bioavailable inhibitor of cyclic nucleotide phosphodiesterase (PDE), mainly PDE-3, -4, -10, and -11, with anti-(neuro)inflammatory, vasorelaxant, bronchodilator, analgesic, neuroprotective and potential anti-tumor activities. Ibudilast (IBD) is able to cross the blood-brain barrier (BBB).
Read more
Upon administration, IBD exerts its potential anti-tumor activity against glioblastoma multiforme (GBM) cells by inhibiting PDE-4 and the pro-inflammatory cytokine macrophage migration inhibitory factor (MIF), which results in a decrease in MIF, its receptor CD74, and AKT expression, and attenuates the immunosuppressive properties of monocytic myeloid-derived suppressor cells (MDSCs) and reduces T-regulatory cells (Tregs). This causes GBM cell apoptosis and inhibits GBM cell proliferation. In addition, IBD reduces, through its inhibitory effect on various PDEs, the production of certain pro-inflammatory cytokines, such as interleukin-6 (IL-6), IL- 1beta, leukotriene B4, and tumor necrosis factor-alpha (TNF-a). IBD also upregulates the anti-inflammatory cytokine (IL-10), and promotes the production of neurotrophic factors, such as brain-derived neurotrophic factor (BDNF), nerve growth factor (NGF), and neurotrophin-4 (NT-4). It also blocks toll-like receptor-4 (TLR-4), inhibits nitric oxide (NO) synthesis and reduces the level of reactive oxygen species (ROS).
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 Ibudilast is traded under.
Heterocyclic compounds with nitrogen hetero-atom(s) only, other
- Slovenia31.7%
- Italy24.2%
- United States5.0%
* Partner reported figures, a lower bound.
The HS code shown for Ibudilast is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Ibudilast, based on the data on this page
What is Ibudilast?
What is the CAS number of Ibudilast?
What is the molecular formula and weight of Ibudilast?
What is Ibudilast used for?
Is Ibudilast hazardous?
What is the HS code of Ibudilast?
Where can I buy Ibudilast?
What is the price of Ibudilast?
Guides for buyers
Practical guides that help when you source, ship or handle Ibudilast
- 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
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
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