2-{4-chloro-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-chloro-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-{4-chloro-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K655-0279 |
| Compound Name: | 2-{4-chloro-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]phenyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 481.95 |
| Molecular Formula: | C26 H25 Cl F N3 O3 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1ccc(c(c1)C(N1CCN(CC1)c1ccc(cc1)F)=O)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1012 |
| logD: | 3.1012 |
| logSw: | -3.6572 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.633 |
| InChI Key: | BYHWLYWEZFXMRJ-UHFFFAOYSA-N |