5,5'-(1,3,6,8-tetraoxo-1,3,6,8-tetrahydrobenzo[lmn][3,8]phenanthroline-2,7-diyl)di(benzene-1,3-dicarboxylic acid)
Chemical Structure Depiction of
5,5'-(1,3,6,8-tetraoxo-1,3,6,8-tetrahydrobenzo[lmn][3,8]phenanthroline-2,7-diyl)di(benzene-1,3-dicarboxylic acid)
5,5'-(1,3,6,8-tetraoxo-1,3,6,8-tetrahydrobenzo[lmn][3,8]phenanthroline-2,7-diyl)di(benzene-1,3-dicarboxylic acid)
Compound characteristics
| Compound ID: | 8002-7447 |
| Compound Name: | 5,5'-(1,3,6,8-tetraoxo-1,3,6,8-tetrahydrobenzo[lmn][3,8]phenanthroline-2,7-diyl)di(benzene-1,3-dicarboxylic acid) |
| Molecular Weight: | 594.45 |
| Molecular Formula: | C30 H14 N2 O12 |
| Smiles: | c1cc2C(N(C(c3ccc4C(N(C(c1c4c23)=O)c1cc(cc(c1)C(O)=O)C(O)=O)=O)=O)c1cc(cc(c1)C(O)=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0871 |
| logD: | -0.0798 |
| logSw: | -3.4644 |
| Hydrogen bond acceptors count: | 20 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 170.15 |
| InChI Key: | RYFYCPDCRKHALS-UHFFFAOYSA-N |