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Suanfarma Suanfarma

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Technical details about ACT-709478, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: Act-709478, 1838651-58-3, 3z7u1u8z9e, N-(1-((5-cyanopyridin-2-yl)methyl)-1h-pyrazol-3-yl)-2-(4-(1-(trifluoromethyl)cyclopropyl)-phenyl)acetamide, Benzeneacetamide, n-[1-[(5-cyano-2-pyridinyl)methyl]-1h-pyrazol-3-yl]-4-[1-(trifluoromethyl)cyclopropyl]-, N-(1-((5-cyanopyridin-2-yl)methyl)pyrazol-3-yl)-2-(4-(1-(trifluoromethyl)cyclopropyl)phenyl)acetamide
Molecular Formula
C22H18F3N5O
Molecular Weight
425.4  g/mol
InChI Key
LSYANGLAZUZYFX-UHFFFAOYSA-N
FDA UNII
3Z7U1U8Z9E

ACT-709478 is under investigation in clinical trial NCT03239691 (A Study to Evaluate the Effect of ACT-709478 in Photosensitive Epilepsy Patients).
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-[1-[(5-cyanopyridin-2-yl)methyl]pyrazol-3-yl]-2-[4-[1-(trifluoromethyl)cyclopropyl]phenyl]acetamide
2.1.2 InChI
InChI=1S/C22H18F3N5O/c23-22(24,25)21(8-9-21)17-4-1-15(2-5-17)11-20(31)28-19-7-10-30(29-19)14-18-6-3-16(12-26)13-27-18/h1-7,10,13H,8-9,11,14H2,(H,28,29,31)
2.1.3 InChI Key
LSYANGLAZUZYFX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1(C2=CC=C(C=C2)CC(=O)NC3=NN(C=C3)CC4=NC=C(C=C4)C#N)C(F)(F)F
2.2 Other Identifiers
2.2.1 UNII
3Z7U1U8Z9E
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Act-709478

2. N-(1-((5-cyanopyridin-2-yl)methyl)pyrazol-3-yl)-2-(4-(1-(trifluoromethyl)cyclopropyl)phenyl)acetamide

2.3.2 Depositor-Supplied Synonyms

1. Act-709478

2. 1838651-58-3

3. 3z7u1u8z9e

4. N-(1-((5-cyanopyridin-2-yl)methyl)-1h-pyrazol-3-yl)-2-(4-(1-(trifluoromethyl)cyclopropyl)-phenyl)acetamide

5. Benzeneacetamide, N-[1-[(5-cyano-2-pyridinyl)methyl]-1h-pyrazol-3-yl]-4-[1-(trifluoromethyl)cyclopropyl]-

6. N-(1-((5-cyanopyridin-2-yl)methyl)pyrazol-3-yl)-2-(4-(1-(trifluoromethyl)cyclopropyl)phenyl)acetamide

7. N-[1-[(5-cyanopyridin-2-yl)methyl]pyrazol-3-yl]-2-[4-[1-(trifluoromethyl)cyclopropyl]phenyl]acetamide

8. Unii-3z7u1u8z9e

9. Chembl4217292

10. Schembl17316866

11. Bcp30302

12. Ex-a3130

13. Bdbm50452245

14. Akos037648975

15. Act 709478

16. Bs-16157

17. Hy-112723

18. Cs-0062884

19. Act709478; Act 709478

20. D80992

2.4 Create Date
2016-02-23
3 Chemical and Physical Properties
Molecular Weight 425.4 g/mol
Molecular Formula C22H18F3N5O
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass425.14634470 g/mol
Monoisotopic Mass425.14634470 g/mol
Topological Polar Surface Area83.6 Ų
Heavy Atom Count31
Formal Charge0
Complexity693
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Calcium Channel Blockers

A class of drugs that act by selective inhibition of calcium influx through cellular membranes. (See all compounds classified as Calcium Channel Blockers.)


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