4-nitro-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
4-nitro-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1H-isoindole-1,3(2H)-dione
4-nitro-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 0093-0008 |
| Compound Name: | 4-nitro-2-(4'-octyl[1,1'-biphenyl]-4-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C28 H28 N2 O4 |
| Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)N1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4611 |
| logD: | 7.4611 |
| logSw: | -5.7837 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.689 |
| InChI Key: | VNYXHFCCIQZFPB-UHFFFAOYSA-N |