3-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
Chemical Structure Depiction of
3-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
3-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 8006-4877 |
| Compound Name: | 3-(5,6-dichloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid |
| Molecular Weight: | 336.13 |
| Molecular Formula: | C15 H7 Cl2 N O4 |
| Smiles: | c1cc(cc(c1)N1C(c2cc(c(cc2C1=O)[Cl])[Cl])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3588 |
| logD: | 1.6692 |
| logSw: | -4.434 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.288 |
| InChI Key: | LIARMWIEXVDOCD-UHFFFAOYSA-N |