2-{2-[2-(4-bromophenyl)-2-oxoethoxy]phenyl}-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{2-[2-(4-bromophenyl)-2-oxoethoxy]phenyl}-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-{2-[2-(4-bromophenyl)-2-oxoethoxy]phenyl}-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5782-4261 |
| Compound Name: | 2-{2-[2-(4-bromophenyl)-2-oxoethoxy]phenyl}-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 454.32 |
| Molecular Formula: | C23 H20 Br N O4 |
| Smiles: | CC1CC2C(CC=1)C(N(C2=O)c1ccccc1OCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3113 |
| logD: | 4.3113 |
| logSw: | -4.558 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.332 |
| InChI Key: | JNXUHUNTMSFFOZ-UHFFFAOYSA-N |