3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl benzenesulfonate
Chemical Structure Depiction of
3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl benzenesulfonate
3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl benzenesulfonate
Compound characteristics
| Compound ID: | 2253-1042 |
| Compound Name: | 3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl benzenesulfonate |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C20 H19 N O5 S |
| Smiles: | C1CCC2C(C1)C(N(C2=O)c1cccc(c1)OS(c1ccccc1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8533 |
| logD: | 2.8533 |
| logSw: | -3.3998 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.834 |
| InChI Key: | IMVNHOYBGDSRFC-UHFFFAOYSA-N |