3-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]piperazine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
3-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]piperazine-1-sulfonyl}benzonitrile
3-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]piperazine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | V002-1657 |
| Compound Name: | 3-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]piperazine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 564.03 |
| Molecular Formula: | C27 H25 Cl F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC(c1ccc(cc1)[Cl])OCc1ccc(cc1)C(F)(F)F)S(c1cccc(C#N)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.223 |
| logD: | 5.2218 |
| logSw: | -6.1064 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.426 |
| InChI Key: | DTEWHCSTWQVEHD-SANMLTNESA-N |