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Chemistry

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Also known as: 175013-84-0, Sb-220453, Sb 220453, Tonabersate, Tonabersat [inn:ban], Unii-2xd9773zmn
Molecular Formula
C20H19ClFNO4
Molecular Weight
391.8  g/mol
InChI Key
XLIIRNOPGJTBJD-ROUUACIJSA-N
FDA UNII
2XD9773ZMN

Tonabersat
TONABERSAT is a small molecule drug with a maximum clinical trial phase of II (across all indications) and has 2 investigational indications.
1 2D Structure

Tonabersat

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-[(3S,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-chloro-4-fluorobenzamide
2.1.2 InChI
InChI=1S/C20H19ClFNO4/c1-10(24)11-5-7-16-13(8-11)17(18(25)20(2,3)27-16)23-19(26)12-4-6-15(22)14(21)9-12/h4-9,17-18,25H,1-3H3,(H,23,26)/t17-,18-/m0/s1
2.1.3 InChI Key
XLIIRNOPGJTBJD-ROUUACIJSA-N
2.2 Other Identifiers
2.2.1 UNII
2XD9773ZMN
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 6-acetyl-4-(3-chloro-4-fluorobenzoylamino)-3,4-dihydro-2,2-dimethyl-2h-benzo(b)pyran-3-ol

2. Sb 220453

3. Sb-220453

2.3.2 Depositor-Supplied Synonyms

1. 175013-84-0

2. Sb-220453

3. Sb 220453

4. Tonabersate

5. Tonabersat [inn:ban]

6. Unii-2xd9773zmn

7. 2xd9773zmn

8. Tonabersat [inn]

9. N-((3s,4s)-6-acetyl-3-hydroxy-2,2-dimethylchroman-4-yl)-3-chloro-4-fluorobenzamide

10. Tonabersat [who-dd]

11. N-[(3s,4s)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-3-chloro-4-fluorobenzamide

12. Benzamide, N-[(3s,4s)-6-acetyl-3,4-dihydro-3-hydroxy-2,2-dimethyl-2h-1-benzopyran-4-yl]-3-chloro-4-fluoro-

13. Dtxsid40169923

14. 6-acetyl-4-(3-chloro-4-fluorobenzoylamino)-3,4-dihydro-2,2-dimethyl-2h-benzo(b)pyran-3-ol

15. 2h-benzo(b)pyran-3-ol, 6-acetyl-4-(3-chloro-4-fluorobenzoylamino)-3,4-dihydro-2,2-dimethyl-

16. N-[(3s,4s)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2h-1-benzopyran-4-yl]-3-chloro-4-fluorobenzamide

17. Usl-260

18. Tonabersatum

19. N-((3s,4s)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2h-1-benzopyran-4-yl)-3-chloro-4-fluorobenzamide

20. N-[(3s,4s)-6-acetyl-3,4-dihydro-3-hydroxy-2,2-dimethyl-2h-1-benzopyran-4-yl]-3-chloro-4-fluoro-benzamide

21. Chembl318191

22. Schembl5917016

23. Dtxcid9092414

24. Tonabersat, >=98% (hplc)

25. Xliirnopgjtbjd-rouuacijsa-n

26. Ex-a11063

27. Mfcd00944458

28. Akos015994581

29. Cs-0676

30. Db06578

31. Es-0039

32. Ncgc00379030-01

33. Hy-15204

34. Sb220453

35. Db-371002

36. Ns00069336

37. Brd-k36970462-001-01-6

38. Q27255763

39. (3s,4s)-6-acetyl-4-(3-chloro-4-fluorobenzamido)-3,4-dihydro-2,2-dimethyl-3-hydroxy-2h-1-benzopyran

40. (3s-cis)-n-(6-acetyl-3,4-dihydro-3-hydroxy-2,2 -(dimethyl-d6)-2h-1-benzopyran-4-yl)-3-chloro-4-fluorobenzamide

2.4 Create Date
2006-07-28
3 Chemical and Physical Properties
Molecular Weight 391.8 g/mol
Molecular Formula C20H19ClFNO4
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area75.6
Heavy Atom Count27
Formal Charge0
Complexity586
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Investigated for use/treatment in migraine and cluster headaches.



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Looking for 175013-84-0 / Tonabersat API manufacturers, exporters & distributors?

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

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Tonabersat manufacturer or Tonabersat supplier.

PharmaCompass also assists you with knowing the Tonabersat API Price utilized in the formulation of products. Tonabersat API Price is not always fixed or binding as the Tonabersat Price is obtained through a variety of data sources. The Tonabersat Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Tonabersat

Synonyms

175013-84-0, Sb-220453, Sb 220453, Tonabersate, Tonabersat [inn:ban], Unii-2xd9773zmn

Cas Number

175013-84-0

Unique Ingredient Identifier (UNII)

2XD9773ZMN

About Tonabersat

TONABERSAT is a small molecule drug with a maximum clinical trial phase of II (across all indications) and has 2 investigational indications.

Tonabersat Manufacturers

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

Tonabersat Suppliers

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

Tonabersat GMP

Tonabersat 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 Tonabersat 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 Tonabersat GMP manufacturer or Tonabersat GMP API supplier for your needs.

Tonabersat CoA

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

Tonabersat CoA mostly includes findings from lab analyses of a specific batch. For each Tonabersat 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.

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