4-{5-[4-(4-carboxybenzene-1-sulfonyl)phenoxy]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoic acid
Chemical Structure Depiction of
4-{5-[4-(4-carboxybenzene-1-sulfonyl)phenoxy]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoic acid
4-{5-[4-(4-carboxybenzene-1-sulfonyl)phenoxy]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoic acid
Compound characteristics
| Compound ID: | 4334-1009 |
| Compound Name: | 4-{5-[4-(4-carboxybenzene-1-sulfonyl)phenoxy]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoic acid |
| Molecular Weight: | 543.51 |
| Molecular Formula: | C28 H17 N O9 S |
| Smiles: | c1cc(ccc1C(O)=O)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)S(c1ccc(cc1)C(O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2284 |
| logD: | 2.1706 |
| logSw: | -5.1328 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.945 |
| InChI Key: | ZESRCOGMCJVTCM-UHFFFAOYSA-N |