3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl 4-bromobenzoate
3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 4483-2529 |
| Compound Name: | 3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl 4-bromobenzoate |
| Molecular Weight: | 440.29 |
| Molecular Formula: | C22 H18 Br N O4 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1cccc(c1)OC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6698 |
| logD: | 3.6698 |
| logSw: | -4.213 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.102 |
| InChI Key: | HZPVVWYOORIVOL-UHFFFAOYSA-N |