2-[4-(adamantan-1-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(adamantan-1-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
2-[4-(adamantan-1-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K212-0025 |
| Compound Name: | 2-[4-(adamantan-1-yl)phenyl]-4,5,6,7-tetrachloro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 495.23 |
| Molecular Formula: | C24 H19 Cl4 N O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1ccc(cc1)N1C(c2c(C1=O)c(c(c(c2[Cl])[Cl])[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.3022 |
| logD: | 7.3022 |
| logSw: | -7.6472 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.6416 |
| InChI Key: | ZODKKLPZVJDAQQ-UHFFFAOYSA-N |