4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
Chemical Structure Depiction of
4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | K781-7551 |
| Compound Name: | 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide |
| Molecular Weight: | 472.59 |
| Molecular Formula: | C28 H32 N4 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)N1CCN(CC1)c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9337 |
| logD: | 6.9318 |
| logSw: | -5.5214 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.521 |
| InChI Key: | GTHKPHUPHXEMHJ-UHFFFAOYSA-N |