2-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
2-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
2-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 4483-3477 |
| Compound Name: | 2-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl 4-bromobenzoate |
| Molecular Weight: | 440.29 |
| Molecular Formula: | C22 H18 Br N O4 |
| Smiles: | CC1CC2C(CC=1)C(N(C2=O)c1ccccc1OC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4846 |
| logD: | 4.4846 |
| logSw: | -4.507 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.236 |
| InChI Key: | BERXNMPMOXOUNS-UHFFFAOYSA-N |