1-(3-chloro-2-methylbenzene-1-sulfonyl)-4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine
Chemical Structure Depiction of
1-(3-chloro-2-methylbenzene-1-sulfonyl)-4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine
1-(3-chloro-2-methylbenzene-1-sulfonyl)-4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine
Compound characteristics
| Compound ID: | V028-9036 |
| Compound Name: | 1-(3-chloro-2-methylbenzene-1-sulfonyl)-4-(2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethyl)piperazine |
| Molecular Weight: | 553.04 |
| Molecular Formula: | C27 H28 Cl F3 N2 O3 S |
| Salt: | not_available |
| Smiles: | Cc1c(cccc1[Cl])S(N1CCN(CC1)CCOC(c1ccccc1)c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1555 |
| logD: | 6.1484 |
| logSw: | -6.2315 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.371 |
| InChI Key: | XJFJOYMTRCTGBS-SANMLTNESA-N |