1-{2-[(3,4-difluorophenyl)(phenyl)methoxy]ethyl}-4-(3-nitrobenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-{2-[(3,4-difluorophenyl)(phenyl)methoxy]ethyl}-4-(3-nitrobenzene-1-sulfonyl)piperazine
1-{2-[(3,4-difluorophenyl)(phenyl)methoxy]ethyl}-4-(3-nitrobenzene-1-sulfonyl)piperazine
Compound characteristics
| Compound ID: | V028-9035 |
| Compound Name: | 1-{2-[(3,4-difluorophenyl)(phenyl)methoxy]ethyl}-4-(3-nitrobenzene-1-sulfonyl)piperazine |
| Molecular Weight: | 517.55 |
| Molecular Formula: | C25 H25 F2 N3 O5 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CCOC(c1ccccc1)c1ccc(c(c1)F)F)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7212 |
| logD: | 4.7141 |
| logSw: | -4.7603 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.752 |
| InChI Key: | QMDCTZXUIWOIJW-VWLOTQADSA-N |