4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitrobenzamide
4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-7064 |
| Compound Name: | 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitrobenzamide |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C26 H28 N4 O3 |
| Smiles: | Cc1cccc(c1)NC(c1ccc(c(c1)[N+]([O-])=O)N1CCN(CC1)c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9555 |
| logD: | 5.9545 |
| logSw: | -5.4485 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.521 |
| InChI Key: | BARSLWGIJJCWDC-UHFFFAOYSA-N |