Molecule ID: 2832487

IUPAC Name: N-(4-bromophenyl)-2-[4-[(4-bromophenyl)carbamoyl]phenyl]-1,3-dioxoisoindole-5-carboxamide

Description: The molecule is a member of the class of isoindoles that is 1H-isoindole-1,3(2H)-dione substituted at position 5 by a 4-bromoanilinocarbonyl group and at position 2 by a 4-[(4-bromophenyl)carbamoyl]phenyl group. It is a member of isoindoles, a member of benzamides and an organobromine compound.

SMILES: O=C(Nc1ccc(Br)cc1)c1ccc2c(c1)C(=O)N(c1ccc(C(O)=Nc3ccc(Br)cc3)cc1)C2=O

SELFIES: [O][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][=C][C][=C][Branch1][P][C][Branch1][C][O][=N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][Ring1][S][C][Ring2][Ring1][#Branch1][=O]

InChI: InChI=1S/C28H17Br2N3O4/c29-18-4-8-20(9-5-18)31-25(34)16-1-12-22(13-2-16)33-27(36)23-14-3-17(15-24(23)28(33)37)26(35)32-21-10-6-19(30)7-11-21/h1-15H,(H,31,34)(H,32,35)

Molecular Properties:
- Polar Surface Area: 95.6 Ų
- LogP: 5.5