1-(4-methylphenyl)-1-oxopropan-2-yl 2-[4-(methoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Chemical Structure Depiction of
1-(4-methylphenyl)-1-oxopropan-2-yl 2-[4-(methoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
1-(4-methylphenyl)-1-oxopropan-2-yl 2-[4-(methoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Compound characteristics
| Compound ID: | 3907-0049 |
| Compound Name: | 1-(4-methylphenyl)-1-oxopropan-2-yl 2-[4-(methoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate |
| Molecular Weight: | 471.47 |
| Molecular Formula: | C27 H21 N O7 |
| Smiles: | CC(C(c1ccc(C)cc1)=O)OC(c1ccc2C(N(C(c2c1)=O)c1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7849 |
| logD: | 4.7849 |
| logSw: | -4.5856 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 83.94 |
| InChI Key: | YTVIWKYMPZLXRW-INIZCTEOSA-N |