Molecule ID: 710962

IUPAC Name: N-(3-fluorophenyl)-2-pyridin-4-ylquinazolin-4-amine

Description: The molecule is a member of the class of quinazolines that is quinazoline which is substituted at positions 2 and 4 by pyridin-4-yl and (3-fluorophenyl)nitrilo groups, respectively. It is a member of quinazolines, a secondary amino compound, an aromatic amine, a member of pyridines, a member of monofluorobenzenes and a substituted aniline.

SMILES: Fc1cccc(N=c2nc(-c3ccncc3)[nH]c3ccccc23)c1

SELFIES: [F][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][=C][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][=C][Ring2][Ring1][#Branch1]

InChI: InChI=1S/C19H13FN4/c20-14-4-3-5-15(12-14)22-19-16-6-1-2-7-17(16)23-18(24-19)13-8-10-21-11-9-13/h1-12H,(H,22,23,24)

Molecular Properties:
- Polar Surface Area: 50.7 Ų
- LogP: 4.1