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BF 126

CAT: 0013-GTR19195414-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195414-01Size:25 mg
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Description
BF 126 is a small molecule tracer developed for the in vivo imaging of tau aggregates, a hallmark pathology of Alzheimer's disease. Its application facilitates non-invasive research into tau deposition and progression in animal models, supporting both preclinical in vivo and in vitro binding studies.
CAS Number
666826-27-3
Smiles
Cc1ccc (cc1) S (O) (=O) =O.CCN (CC) c1ccc (C=Cc2nc3ccccc3[nH]2) cc1 |w:21.21|
Molecular Formula
C26H29N3O3S
Molecular Weight
463.6
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

BF 126
CAS Number666826-27-3
PubChem CID10367144
IUPAC Name4-[(E)-2-(1H-benzimidazol-2-yl)ethenyl]-N,N-diethylaniline;4-methylbenzenesulfonic acid
Molecular FormulaC26H29N3O3S
Molecular Weight463.6
Topological Polar Surface Area94.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity562
SMILES
CCN(CC)C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3N2.CC1=CC=C(C=C1)S(=O)(=O)O
InChI
InChI=1S/C19H21N3.C7H8O3S/c1-3-22(4-2)16-12-9-15(10-13-16)11-14-19-20-17-7-5-6-8-18(17)21-19;1-6-2-4-7(5-3-6)11(8,9)10/h5-14H,3-4H2,1-2H3,(H,20,21);2-5H,1H3,(H,8,9,10)/b14-11+;
InChIKey
CCCFPXPTFYRLGJ-JHGYPSGKSA-N
Chemical Structure
2D Structure
2D structure of BF 126
CAS: 666826-27-3
CID: 10367144
Formula: C26H29N3O3S
MW: 463.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight463.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass463.19296297
Monoisotopic Mass463.19296297
Topological Polar Surface Area94.7 Ų
Heavy Atom Count33
Formal Charge0
Complexity562
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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