Molecule ID: 20580278

IUPAC Name: 2,3,7,8,12,13,17,18-octaethylporphyrin;platinum

Description: The molecule is a platinum(II) porphyrin compound having eight ethyl substituents in the 2-, 3-, 7-, 8-, 12-, 13-, 17- and 18-positions. It has a role as a fluorochrome.

SMILES: CCC1=C(CC)C2=NC1=CC1=NC(=CC3=NC(=CC4=NC(=C2)C(CC)=C4CC)C(CC)=C3CC)C(CC)=C1CC.[Pt]

SELFIES: [C][C][C][=C][Branch1][Ring1][C][C][C][=N][C][Ring1][#Branch1][=C][C][=N][C][=Branch2][Ring2][=Branch1][=C][C][=N][C][=Branch2][Ring1][Ring2][=C][C][=N][C][=Branch1][Ring2][=C][Ring1][S][C][Branch1][Ring1][C][C][=C][Ring1][Branch2][C][C][C][Branch1][Ring1][C][C][=C][Ring2][Ring1][C][C][C][C][Branch1][Ring1][C][C][=C][Ring2][Ring1][N][C][C].[Pt]

InChI: InChI=1S/C36H44N4.Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/h17-20H,9-16H2,1-8H3;

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