1-(4-bromobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
Chemical Structure Depiction of
1-(4-bromobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
1-(4-bromobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
Compound characteristics
| Compound ID: | 4376-0310 |
| Compound Name: | 1-(4-bromobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine |
| Molecular Weight: | 699.5 |
| Molecular Formula: | C27 H26 Br F3 N6 O6 S |
| Smiles: | C1CN(CCN1c1ccc(c(c1)N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1786 |
| logD: | 6.1786 |
| logSw: | -6.2809 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 107.482 |
| InChI Key: | DIJGRMVXOWVTRU-UHFFFAOYSA-N |