4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 4483-2764 |
| Compound Name: | 4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate |
| Molecular Weight: | 442.31 |
| Molecular Formula: | C22 H20 Br N O4 |
| Smiles: | CC1CCC2C(C1)C(N(C2=O)c1ccc(cc1)OC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4262 |
| logD: | 4.4262 |
| logSw: | -4.4036 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.45 |
| InChI Key: | YTCLHUBKKIDIGF-UHFFFAOYSA-N |