2-[4-(1,3-benzoxazol-2-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(1,3-benzoxazol-2-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
2-[4-(1,3-benzoxazol-2-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K212-0005 |
| Compound Name: | 2-[4-(1,3-benzoxazol-2-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 478.12 |
| Molecular Formula: | C21 H8 Cl4 N2 O3 |
| Smiles: | c1ccc2c(c1)nc(c1ccc(cc1)N1C(c3c(C1=O)c(c(c(c3[Cl])[Cl])[Cl])[Cl])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.6162 |
| logD: | 5.6162 |
| logSw: | -7.174 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.69 |
| InChI Key: | WBXBOFLIPUTZPC-UHFFFAOYSA-N |