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Soticlestat
Also known as: Ov935, 1429505-03-2, Tak-935, Soticlestat [inn], Soticlestat [usan], Ov-935
Molecular Formula
C23H23N3O2
Molecular Weight
373.4  g/mol
InChI Key
XKUZMIUSBMCVPP-UHFFFAOYSA-N
FDA UNII
1766MU795L

1 2D Structure

Soticlestat

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4-benzyl-4-hydroxypiperidin-1-yl)-(2-pyridin-4-ylpyridin-3-yl)methanone
2.1.2 InChI
InChI=1S/C23H23N3O2/c27-22(20-7-4-12-25-21(20)19-8-13-24-14-9-19)26-15-10-23(28,11-16-26)17-18-5-2-1-3-6-18/h1-9,12-14,28H,10-11,15-17H2
2.1.3 InChI Key
XKUZMIUSBMCVPP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(CCC1(CC2=CC=CC=C2)O)C(=O)C3=C(N=CC=C3)C4=CC=NC=C4
2.2 Other Identifiers
2.2.1 UNII
1766MU795L
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (4-benzyl-4-hydroxy-1-piperidinyl)(2,4'-bipyridin-3-yl)methanone

2. Ov-935

3. Ov935

2.3.2 Depositor-Supplied Synonyms

1. Ov935

2. 1429505-03-2

3. Tak-935

4. Soticlestat [inn]

5. Soticlestat [usan]

6. Ov-935

7. Tak935

8. Soticlestat (usan)

9. 1766mu795l

10. (4-benzyl-4-hydroxypiperidin-1-yl)-(2-pyridin-4-ylpyridin-3-yl)methanone

11. [4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]-(2-pyridin-4-ylpyridin-3-yl)methanone

12. Soticlestat [usan:inn]

13. Chembl4298172

14. Schembl14841089

15. Unii-1766mu795l

16. Gtpl11517

17. Who 10844

18. Hy-109123

19. Cs-0078356

20. D11590

21. (4-benzyl-4-hydroxypiperidin-1-yl) (2,4'-bipyridin-3-yl)methanone

22. (4-benzyl-4-hydroxypiperidin-1-yl)(2,4'-bipyridin-3-yl)methanone

23. [2,4'-bipyridin]-3-yl(4-benzyl-4-hydroxypiperidin-1-yl)methanone

24. 2,4'-bipyridin-3-yl(4-benzyl-4-hydroxypiperidin-1-yl)methanone

25. Ybs

2.4 Create Date
2014-04-21
3 Chemical and Physical Properties
Molecular Weight 373.4 g/mol
Molecular Formula C23H23N3O2
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass373.17902698 g/mol
Monoisotopic Mass373.17902698 g/mol
Topological Polar Surface Area66.3 Ų
Heavy Atom Count28
Formal Charge0
Complexity506
Isotope Atom Count0
Defined Atom Stereocenter Count0
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

Treatment of Chromosome 15q Duplication Syndrome, Treatment of Cyclin-Dependent Kinase-Like 5 deficiency disorder


Treatment of Dravet syndrome, Treatment of Lennox-Gastaut syndrome


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