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Chemical structure of 4-(6-Bromo-2-benzothiazolyl)benzenamine

GC31208

4-(6-Bromo-2-benzothiazolyl)benzenamine

Also known as 4-(6-bromo-1,3-benzothiazol-2-yl)aniline

4-(6-Bromo-2-benzothiazolyl)benzenamine is a β-amyloid PET (positron emission tomography) tracer that can be used in the diagnosis of neurological diseases, such as Alzheimer's and Down's syndrome

ChemicalCAS566169-97-9MW305.19FormulaC13H9BrN2S
CAS number
566169-97-9
Molecular weight
305.19
Formula
C13H9BrN2S
Solubility
Soluble in DMSO
InChIKey
WZRRXNJALRCBNH-UHFFFAOYSA-N
Catalogue number
GC31208
Brand
GLPBIO
Computed properties PubChem CID 10335228 · XLogP 4.3 · TPSA 67.2 Ų · H-bond donors 1
XLogP
4.3
TPSA
67.2 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17

SMILES C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)Br)N

Computed descriptors from PubChem (CID 10335228), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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