Molecule ID: 817368

IUPAC Name: 4-iodo-6-phenylpyrimidine

Description: The molecule is a member of the class of pyrimidines carrying iodo and phenyl substituents at positions 4 and 6 respectively. It has a role as a macrophage migration inhibitory factor inhibitor, an antineoplastic agent and an apoptosis inducer. It is a member of pyrimidines, a biaryl and an organoiodine compound.

SMILES: Ic1cc(-c2ccccc2)ncn1

SELFIES: [I][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=N][Ring1][N]

InChI: InChI=1S/C10H7IN2/c11-10-6-9(12-7-13-10)8-4-2-1-3-5-8/h1-7H

Molecular Properties:
- Polar Surface Area: 25.8 Ų
- LogP: 2.6