T807

CAT: 0127-BUP09700-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP09700-01Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1415379-56-4

Synonyms

AV-1451

Purity

=98%

Smiles

Fc1ccc(cn1)-c1ccc2c(c1)[nH]c1ccncc21

Chemical Information

Flortaucipir

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

CAS Number	1415379-56-4
PubChem CID	71059746
IUPAC Name	7-(6-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole
Molecular Formula	C16H10FN3
Molecular Weight	263.27
XLogP	3.3
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	20
Formal Charge	0
Complexity	351

SMILES

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

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

InChIKey

GETAAWDSFUCLBS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1415379-56-4

CID: 71059746

Formula: C16H10FN3

MW: 263.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	263.27
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	263.08587549
Monoisotopic Mass	263.08587549
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
Compound Is Canonicalized	Yes