1-[4-nitro-2-(trifluoromethyl)phenyl]-4-(phenylmethanesulfonyl)piperazine
Chemical Structure Depiction of
1-[4-nitro-2-(trifluoromethyl)phenyl]-4-(phenylmethanesulfonyl)piperazine
1-[4-nitro-2-(trifluoromethyl)phenyl]-4-(phenylmethanesulfonyl)piperazine
Compound characteristics
| Compound ID: | 8013-4790 |
| Compound Name: | 1-[4-nitro-2-(trifluoromethyl)phenyl]-4-(phenylmethanesulfonyl)piperazine |
| Molecular Weight: | 429.42 |
| Molecular Formula: | C18 H18 F3 N3 O4 S |
| Smiles: | C1CN(CCN1c1ccc(cc1C(F)(F)F)[N+]([O-])=O)S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5316 |
| logD: | 3.5316 |
| logSw: | -3.9607 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.185 |
| InChI Key: | OYPXZRZKINBIMR-UHFFFAOYSA-N |