5-(4-benzylpiperazin-1-yl)-N-[2-(3-methylphenoxy)ethyl]-2-nitroaniline
Chemical Structure Depiction of
5-(4-benzylpiperazin-1-yl)-N-[2-(3-methylphenoxy)ethyl]-2-nitroaniline
5-(4-benzylpiperazin-1-yl)-N-[2-(3-methylphenoxy)ethyl]-2-nitroaniline
Compound characteristics
| Compound ID: | 8014-2996 |
| Compound Name: | 5-(4-benzylpiperazin-1-yl)-N-[2-(3-methylphenoxy)ethyl]-2-nitroaniline |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C26 H30 N4 O3 |
| Smiles: | Cc1cccc(c1)OCCNc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5742 |
| logD: | 5.4677 |
| logSw: | -5.5297 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.108 |
| InChI Key: | CSGSHRKZLBXVKG-UHFFFAOYSA-N |