2-[4-(3-{[1-(4-bromophenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol
Chemical Structure Depiction of
2-[4-(3-{[1-(4-bromophenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol
2-[4-(3-{[1-(4-bromophenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol
Compound characteristics
| Compound ID: | 8011-4987 |
| Compound Name: | 2-[4-(3-{[1-(4-bromophenyl)ethyl]amino}-4-nitrophenyl)piperazin-1-yl]ethan-1-ol |
| Molecular Weight: | 449.35 |
| Molecular Formula: | C20 H25 Br N4 O3 |
| Smiles: | CC(c1ccc(cc1)[Br])Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)CCO |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7289 |
| logD: | 3.5679 |
| logSw: | -4.0447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.917 |
| InChI Key: | NXBSFISOTGDCJX-HNNXBMFYSA-N |