1-{2,6-dinitro-4-[(trifluoromethyl)sulfanyl]phenyl}piperazine
Chemical Structure Depiction of
1-{2,6-dinitro-4-[(trifluoromethyl)sulfanyl]phenyl}piperazine
1-{2,6-dinitro-4-[(trifluoromethyl)sulfanyl]phenyl}piperazine
Compound characteristics
| Compound ID: | 8012-6068 |
| Compound Name: | 1-{2,6-dinitro-4-[(trifluoromethyl)sulfanyl]phenyl}piperazine |
| Molecular Weight: | 352.29 |
| Molecular Formula: | C11 H11 F3 N4 O4 S |
| Smiles: | C1CN(CCN1)c1c(cc(cc1[N+]([O-])=O)SC(F)(F)F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9774 |
| logD: | 2.9428 |
| logSw: | -4.4948 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.211 |
| InChI Key: | MUEVHWRZNRLOQA-UHFFFAOYSA-N |