2-oxo-2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl 4'-bromo[1,1'-biphenyl]-4-carboxylate
Chemical Structure Depiction of
2-oxo-2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl 4'-bromo[1,1'-biphenyl]-4-carboxylate
2-oxo-2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl 4'-bromo[1,1'-biphenyl]-4-carboxylate
Compound characteristics
| Compound ID: | 0459-0033 |
| Compound Name: | 2-oxo-2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl 4'-bromo[1,1'-biphenyl]-4-carboxylate |
| Molecular Weight: | 541.49 |
| Molecular Formula: | C32 H29 Br O3 |
| Smiles: | CCCCCc1ccc(cc1)c1ccc(cc1)C(COC(c1ccc(cc1)c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 10.2836 |
| logD: | 10.2836 |
| logSw: | -5.8554 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.8 |
| InChI Key: | UKFXGIIGDXUEAD-UHFFFAOYSA-N |