2-{4-[2-(1,3-benzoxazol-2-yl)ethyl]phenyl}-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-[2-(1,3-benzoxazol-2-yl)ethyl]phenyl}-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
2-{4-[2-(1,3-benzoxazol-2-yl)ethyl]phenyl}-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K212-0020 |
| Compound Name: | 2-{4-[2-(1,3-benzoxazol-2-yl)ethyl]phenyl}-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 506.17 |
| Molecular Formula: | C23 H12 Cl4 N2 O3 |
| Smiles: | C(Cc1nc2ccccc2o1)c1ccc(cc1)N1C(c2c(C1=O)c(c(c(c2[Cl])[Cl])[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4457 |
| logD: | 6.4457 |
| logSw: | -7.3309 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.356 |
| InChI Key: | CLTRFRRFJDNSEL-UHFFFAOYSA-N |