4,7-dimethyl-5,6-diphenyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
4,7-dimethyl-5,6-diphenyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
4,7-dimethyl-5,6-diphenyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 2140-0150 |
| Compound Name: | 4,7-dimethyl-5,6-diphenyl-2-[3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 501.5 |
| Molecular Formula: | C30 H22 F3 N O3 |
| Smiles: | CC12C3C(C(N(C3=O)c3cccc(c3)C(F)(F)F)=O)C(C)(C(=C1c1ccccc1)c1ccccc1)C2=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0072 |
| logD: | 5.0072 |
| logSw: | -4.7899 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.328 |
| InChI Key: | RSCDMDSPNONARK-UHFFFAOYSA-N |