4,4'-{carbonylbis[3,1-phenylene(1,3-dioxo-1,3-dihydro-2H-isoindole-2,5-diyl)sulfonyl]}dibenzoic acid
Chemical Structure Depiction of
4,4'-{carbonylbis[3,1-phenylene(1,3-dioxo-1,3-dihydro-2H-isoindole-2,5-diyl)sulfonyl]}dibenzoic acid
4,4'-{carbonylbis[3,1-phenylene(1,3-dioxo-1,3-dihydro-2H-isoindole-2,5-diyl)sulfonyl]}dibenzoic acid
Compound characteristics
| Compound ID: | 8005-4058 |
| Compound Name: | 4,4'-{carbonylbis[3,1-phenylene(1,3-dioxo-1,3-dihydro-2H-isoindole-2,5-diyl)sulfonyl]}dibenzoic acid |
| Molecular Weight: | 840.8 |
| Molecular Formula: | C43 H24 N2 O13 S2 |
| Smiles: | c1cc(cc(c1)N1C(c2ccc(cc2C1=O)S(c1ccc(cc1)C(O)=O)(=O)=O)=O)C(c1cccc(c1)N1C(c2ccc(cc2C1=O)S(c1ccc(cc1)C(O)=O)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.771 |
| logD: | 3.7132 |
| logSw: | -6.0167 |
| Hydrogen bond acceptors count: | 24 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 186.806 |
| InChI Key: | AZWNTLPQRLHHLN-UHFFFAOYSA-N |