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Chemistry

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Also known as: 1415379-56-4, T807, T-807, Flortaucipir, J09qs3z3wb, 5h-pyrido(4,3-b)indole, 7-(6-fluoro-3-pyridinyl)-

Molecular Formula

C₁₆H₁₀FN₃

Molecular Weight

263.27 g/mol

InChI Key

GETAAWDSFUCLBS-UHFFFAOYSA-N

FDA UNII

J09QS3Z3WB

Flortaucipir is under investigation in clinical trial NCT03507257 (Longitudinal Early-onset Alzheimer's Disease Study Protocol).

1 2D Structure

Flortaucipir

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

7-(6-fluoropyridin-3-yl)-5H-pyrido[4,3-b]indole

2.1.2 InChI

InChI=1S/C16H10FN3/c17-16-4-2-11(8-19-16)10-1-3-12-13-9-18-6-5-14(13)20-15(12)7-10/h1-9,20H

2.1.3 InChI Key

GETAAWDSFUCLBS-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC2=C(C=C1C3=CN=C(C=C3)F)NC4=C2C=NC=C4

2.2 Other Identifiers

2.2.1 UNII

J09QS3Z3WB

2.3 Synonyms

2.3.1 MeSH Synonyms

1. (18)av-1451

2. (18f)1451

3. (18f)av-1451

4. (18f)flortaucipir

5. (18f)t807 Compound

6. (f-18)-av-1451

7. (f-18)t807

8. 7-(6-fluoropyridin-3-yl)-5h-pyrido(4,3-b)indole

9. Av-1451

10. Av1451

11. F-18-av-1451

12. Flortaucipir

13. Flortaucipir (18f)

14. Flortaucipir (f 18)

15. Flortaucipir (f-18)

16. T-807

17. T-807 F-18

18. T807 Compound

2.3.2 Depositor-Supplied Synonyms

1. 1415379-56-4

2. T807

3. T-807

4. Flortaucipir

5. J09qs3z3wb

6. 5h-pyrido(4,3-b)indole, 7-(6-fluoro-3-pyridinyl)-

7. 7-(6-fluoropyridin-3-yl)-5h-pyrido(4,3-b)indole

8. Unii-j09qs3z3wb

9. 7-(6-fluoranylpyridin-3-yl)-5h-pyrido[4,3-b]indole

10. Flortaucipir (f-18)

11. Chembl3546271

12. Schembl14053964

13. Dtxsid701027894

14. Bcp24019

15. Av1451

16. Zinc148048492

17. Av-1451av-1451

18. Cs-6898

19. Db15033

20. Bs-15380

21. Hy-101184

22. Ft-0699855

23. C72630

24. A910886

25. 7-(6-fluoro-3-pyridinyl)-5h-pyrido[4,3-b]indole

26. Q27280989

27. T807(f18); Ly 3191748;7-(6-(fluoro-18f)pyridin-3-yl)-5h-pyrido[4,3-b]indole

2.4 Create Date

2013-03-21

3 Chemical and Physical Properties

Molecular Formula	C₁₆H₁₀FN₃
Molecular Weight	263.27 g/mol
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	263.08587549 g/mol
Monoisotopic Mass	263.08587549 g/mol
Topological Polar Surface Area	41.6 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	351
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1