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Chemistry

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Also known as: Ati-450, Zunsemetinib [inn], Ati450, Cdd450, Zunsemetinib [usan], Cdd-450
Molecular Formula
C25H22ClF2N5O3
Molecular Weight
513.9  g/mol
InChI Key
FQPQMJULRZINPV-UHFFFAOYSA-N
FDA UNII
AX2VWG0ZCR

Zunsemetinib
Zunsemetinib is an orally bioavailable, small molecule inhibitor of mitogen-activated protein (MAP) kinase-activated protein kinase 2 (MAPKAPK2; MK2), with potential anti-inflammatory activity. Upon oral administration, zunsemetinib targets and binds to the p38MAPK-MK2 complex, thereby inhibiting the p38MAPK phosphorylation and activation of MK2. This inhibits p38MAPK/MK2-mediated inflammatory signaling pathway. This may result in the inhibition of the production of proinflammatory cytokines, including tumor necrosis factor-alpha (TNF-alpha), interleukin (IL)-1-alpha, IL-1-beta and IL-6.
1 2D Structure

Zunsemetinib

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-chloro-4-[(3,5-difluoropyridin-2-yl)methoxy]-1-[2-[2-(2-hydroxypropan-2-yl)pyrimidin-4-yl]-5-methylpyridin-4-yl]-6-methylpyridin-2-one
2.1.2 InChI
InChI=1S/C25H22ClF2N5O3/c1-13-10-30-18(17-5-6-29-24(32-17)25(3,4)35)9-20(13)33-14(2)7-21(22(26)23(33)34)36-12-19-16(28)8-15(27)11-31-19/h5-11,35H,12H2,1-4H3
2.1.3 InChI Key
FQPQMJULRZINPV-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC(=C(C(=O)N1C2=CC(=NC=C2C)C3=NC(=NC=C3)C(C)(C)O)Cl)OCC4=C(C=C(C=N4)F)F
2.2 Other Identifiers
2.2.1 UNII
AX2VWG0ZCR
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Ati-450

2. Zunsemetinib [inn]

3. Ati450

4. Cdd450

5. Zunsemetinib [usan]

6. Cdd-450

7. Ax2vwg0zcr

8. (1(2h),4'-bipyridin)-2-one, 3-chloro-4-((3,5-difluoro-2-pyridinyl)methoxy)-2'-(2-(1-hydroxy-1-methylethyl)-4-pyrimidinyl)-5',6-dimethyl-, (-)-

9. (p)-3-chloro-4-((3,5-difluoropyridin-2-yl)methoxy)-2'-(2-(2-hydroxypropan-2-yl)pyrimidin-4-yl)-5',6-dimethyl-2h-(1,4'-bipyridin)-2-one

10. 1640282-42-3

11. Unii-ax2vwg0zcr

12. Zunsemetinib [usan:inn]

13. Ati 450

14. Ati 450 [who-dd]

15. Chembl3704901

16. Schembl16279876

17. Gtpl11681

18. Bdbm175242

19. Ex-a6292

20. Who 11983

21. Hy-139553

22. Cs-0204147

23. Us9115089, 49

24. 1639791-42-6

25. 3-chloro-4-[(3,5-difluoropyridin-2-yl)methoxy]-1-[2-[2-(2-hydroxypropan-2-yl)pyrimidin-4-yl]-5-methylpyridin-4-yl]-6-methylpyridin-2-one

2.4 Create Date
2014-12-22
3 Chemical and Physical Properties
Molecular Weight 513.9 g/mol
Molecular Formula C25H22ClF2N5O3
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area101
Heavy Atom Count36
Formal Charge0
Complexity888
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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ABOUT THIS PAGE

Zunsemetinib Manufacturers

A Zunsemetinib manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Zunsemetinib, including repackagers and relabelers. The FDA regulates Zunsemetinib manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Zunsemetinib API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Zunsemetinib Suppliers

A Zunsemetinib supplier is an individual or a company that provides Zunsemetinib active pharmaceutical ingredient (API) or Zunsemetinib finished formulations upon request. The Zunsemetinib suppliers may include Zunsemetinib API manufacturers, exporters, distributors and traders.

Zunsemetinib GMP

Zunsemetinib Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Zunsemetinib GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Zunsemetinib GMP manufacturer or Zunsemetinib GMP API supplier for your needs.

Zunsemetinib CoA

A Zunsemetinib CoA (Certificate of Analysis) is a formal document that attests to Zunsemetinib's compliance with Zunsemetinib specifications and serves as a tool for batch-level quality control.

Zunsemetinib CoA mostly includes findings from lab analyses of a specific batch. For each Zunsemetinib CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Zunsemetinib may be tested according to a variety of international standards, such as European Pharmacopoeia (Zunsemetinib EP), Zunsemetinib JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Zunsemetinib USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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