Molecule ID: 192816

IUPAC Name: 3,6-bis[(4-hydroxyphenyl)methyl]piperazine-2,5-dione

Description: The molecule is a member of the class of 2,5-diketopiperazines that is piperazine-2,5-dione in which one hydrogen at position 3 and one hydrogen at position 6 are replaced by p-hydroxybenzyl groups.

SMILES: OC1=NC(Cc2ccc(O)cc2)C(O)=NC1Cc1ccc(O)cc1

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

InChI: InChI=1S/C18H18N2O4/c21-13-5-1-11(2-6-13)9-15-17(23)20-16(18(24)19-15)10-12-3-7-14(22)8-4-12/h1-8,15-16,21-22H,9-10H2,(H,19,24)(H,20,23)

Molecular Properties:
- Polar Surface Area: 98.7 Ų
- LogP: 2.0