Molecule ID: 4060

IUPAC Name: 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione

Description: The molecule is an imidazolidine-2,4-dione (hydantoin) in which the imidazolidine nucleus carries a methyl group at N-3 and has ethyl and phenyl substituents at C-5. An anticonvulsant, it is no longer available in the USA or the UK but is still studied largely because of its interesting hydroxylation polymorphism. It has a role as an anticonvulsant.

SMILES: CCC1(c2ccccc2)N=C(O)N(C)C1=O

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

InChI: InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)

Molecular Properties:
- Polar Surface Area: 49.4 Ų
- LogP: 1.5