3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-methylbenzoate
Chemical Structure Depiction of
3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-methylbenzoate
3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 5782-4595 |
| Compound Name: | 3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-methylbenzoate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C22 H21 N O4 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1cccc(c1)N1C(C2CCCCC2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5836 |
| logD: | 3.5836 |
| logSw: | -3.7406 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.45 |
| InChI Key: | DHUONFGEZUEDGK-UHFFFAOYSA-N |