2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 2922-0875 |
| Compound Name: | 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 477.43 |
| Molecular Formula: | C27 H15 N3 O6 |
| Smiles: | c1ccc2c(c1)nc(c1cccc(c1)N1C(c3ccc(cc3C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.0347 |
| logD: | 6.0347 |
| logSw: | -6.0133 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.819 |
| InChI Key: | KULAYMXVKYSWGI-UHFFFAOYSA-N |