1-(4-chlorobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
1-(4-chlorobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine
Compound characteristics
| Compound ID: | 8013-4841 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-4-(4-nitro-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}phenyl)piperazine |
| Molecular Weight: | 655.05 |
| Molecular Formula: | C27 H26 Cl 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)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9395 |
| logD: | 5.9395 |
| logSw: | -6.501 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 107.482 |
| InChI Key: | BWPWBBNYOPCGKN-UHFFFAOYSA-N |