4-[(2-{2-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)oxy]benzoic acid
Chemical Structure Depiction of
4-[(2-{2-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)oxy]benzoic acid
4-[(2-{2-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)oxy]benzoic acid
Compound characteristics
Compound ID: | 8009-8818 |
Compound Name: | 4-[(2-{2-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)oxy]benzoic acid |
Molecular Weight: | 521.44 |
Molecular Formula: | C29 H15 N O9 |
Smiles: | c1ccc(c(c1)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)C(O)=O)=O)Oc1ccc2C(=O)OC(c2c1)=O |
Stereo: | ACHIRAL |
logP: | 4.9054 |
logD: | 2.3879 |
logSw: | -4.5636 |
Hydrogen bond acceptors count: | 14 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 105.693 |
InChI Key: | DGELMJOPZGVRQF-UHFFFAOYSA-N |