2-[2-chloro-5-(trifluoromethyl)phenyl]-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
2-[2-chloro-5-(trifluoromethyl)phenyl]-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
2-[2-chloro-5-(trifluoromethyl)phenyl]-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 2360-0507 |
| Compound Name: | 2-[2-chloro-5-(trifluoromethyl)phenyl]-4,5,6,7-tetraphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 660.09 |
| Molecular Formula: | C40 H25 Cl F3 N O3 |
| Smiles: | c1ccc(cc1)C1=C(c2ccccc2)C2(C3C(C(N(C3=O)c3cc(ccc3[Cl])C(F)(F)F)=O)C1(C2=O)c1ccccc1)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.1289 |
| logD: | 8.1241 |
| logSw: | -6.9005 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.484 |
| InChI Key: | VAHHUMCHSOLLMJ-UHFFFAOYSA-N |