2-(4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)hexahydro-1H-isoindole-1,3(2H)-dione
2-(4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8017-4963 |
| Compound Name: | 2-(4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}phenyl)hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 485.51 |
| Molecular Formula: | C26 H26 F3 N3 O3 |
| Smiles: | C1CCC2C(C1)C(N(C2=O)c1ccc(cc1)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3126 |
| logD: | 3.3126 |
| logSw: | -3.5981 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.981 |
| InChI Key: | RJNBTBXZQOLDBI-UHFFFAOYSA-N |