5-[4-(methanesulfonyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline
Chemical Structure Depiction of
5-[4-(methanesulfonyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline
5-[4-(methanesulfonyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline
Compound characteristics
| Compound ID: | 8011-1158 |
| Compound Name: | 5-[4-(methanesulfonyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Smiles: | CC(CCc1ccccc1)Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6976 |
| logD: | 3.6976 |
| logSw: | -4.023 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.032 |
| InChI Key: | MYHATGYCPPREHL-KRWDZBQOSA-N |