Molecule ID: 11501341

IUPAC Name: 4-[(E)-2-[4-[2-[2-(2-(18F)fluoranylethoxy)ethoxy]ethoxy]phenyl]ethenyl]-N-methylaniline

Description: The molecule is a member of the class of stilbenoids in which the para-hydrogens of stilbene are replaced by methylamino and 2-{2-[2-((18)F)fluoroethoxy]ethoxy}ethoxy) groups. A positron emission tomography imaging ligand for the detection of amyloid aggregation associated with Alzheimer disease. It has a role as a radioactive imaging agent. It is a stilbenoid, a substituted aniline, a secondary amino compound, a (18)F radiopharmaceutical, a polyether and an aromatic ether.

SMILES: CNc1ccc(/C=C/c2ccc(OCCOCCOCC[18F])cc2)cc1

SELFIES: [C][N][C][=C][C][=C][Branch2][Ring1][#Branch1][/C][=C][/C][=C][C][=C][Branch1][O][O][C][C][O][C][C][O][C][C][18F][C][=C][Ring1][S][C][=C][Ring2][Ring1][Branch2]

InChI: InChI=1S/C21H26FNO3/c1-23-20-8-4-18(5-9-20)2-3-19-6-10-21(11-7-19)26-17-16-25-15-14-24-13-12-22/h2-11,23H,12-17H2,1H3/b3-2+/i22-1

Molecular Properties:
- Polar Surface Area: 39.7 Ų
- LogP: 4.2