1-oxo-1-phenylpropan-2-yl 3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate
Chemical Structure Depiction of
1-oxo-1-phenylpropan-2-yl 3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate
1-oxo-1-phenylpropan-2-yl 3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate
Compound characteristics
| Compound ID: | 4483-3276 |
| Compound Name: | 1-oxo-1-phenylpropan-2-yl 3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzoate |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C25 H23 N O5 |
| Smiles: | CC1C=CCC2C1C(N(C2=O)c1cccc(c1)C(=O)OC(C)C(c1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1021 |
| logD: | 3.1021 |
| logSw: | -3.368 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.958 |
| InChI Key: | DRCFSQJNAJGGFF-UHFFFAOYSA-N |