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BIBD-124

CAT: 0013-GTR19220929-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19220929-01Size:5 mg
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Description
BIBD-124 is a high-affinity ligand for amyloid beta plaques, exhibiting an IC50 of 9.51 nM. Its radiolabeled analog, [18F]BIBD-124, is utilized as a PET radiotracer for the in vivo imaging and quantification of Aβ pathology in Alzheimer's disease research models.
CAS Number
2716871-93-9
Field of Research
Neuroscience
Smiles
C (=C/C=1C=CC (NC) =NC1) \C=2C=CC (OCCOCCOCCF) =NC2
Molecular Formula
C19H24FN3O3
Molecular Weight
361.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-[(E)-2-[6-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-3-pyridinyl]ethenyl]-N-methylpyridin-2-amine
CAS Number2716871-93-9
PubChem CID168355622
IUPAC Name5-[(E)-2-[6-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-3-pyridinyl]ethenyl]-N-methylpyridin-2-amine
Molecular FormulaC19H24FN3O3
Molecular Weight361.4
XLogP2.7
Topological Polar Surface Area65.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Heavy Atom Count26
Formal Charge0
Complexity387
SMILES
CNC1=NC=C(C=C1)/C=C/C2=CN=C(C=C2)OCCOCCOCCF
InChI
InChI=1S/C19H24FN3O3/c1-21-18-6-4-16(14-22-18)2-3-17-5-7-19(23-15-17)26-13-12-25-11-10-24-9-8-20/h2-7,14-15H,8-13H2,1H3,(H,21,22)/b3-2+
InChIKey
NRJYGPSTZQALLN-NSCUHMNNSA-N
Chemical Structure
2D Structure
2D structure of 5-[(E)-2-[6-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]-3-pyridinyl]ethenyl]-N-methylpyridin-2-amine
CAS: 2716871-93-9
CID: 168355622
Formula: C19H24FN3O3
MW: 361.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight361.4
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Exact Mass361.18016980
Monoisotopic Mass361.18016980
Topological Polar Surface Area65.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity387
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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