3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-chlorobenzoate
Chemical Structure Depiction of
3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-chlorobenzoate
3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-chlorobenzoate
Compound characteristics
| Compound ID: | 3043-0157 |
| Compound Name: | 3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-chlorobenzoate |
| Molecular Weight: | 397.86 |
| Molecular Formula: | C22 H20 Cl N O4 |
| Smiles: | CC1CCC2C(C1)C(N(C2=O)c1cccc(c1)OC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2834 |
| logD: | 4.2834 |
| logSw: | -4.7678 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.45 |
| InChI Key: | ZIZDBJDOPITEJP-UHFFFAOYSA-N |