2-(4-benzylpiperazin-1-yl)-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}acetamide
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}acetamide
2-(4-benzylpiperazin-1-yl)-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}acetamide
Compound characteristics
| Compound ID: | 8016-6371 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-N-{3-[2-nitro-4-(trifluoromethyl)anilino]propyl}acetamide |
| Molecular Weight: | 479.5 |
| Molecular Formula: | C23 H28 F3 N5 O3 |
| Smiles: | C(CNC(CN1CCN(CC1)Cc1ccccc1)=O)CNc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.3213 |
| logD: | 3.1823 |
| logSw: | -3.713 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.555 |
| InChI Key: | BVRPFQZAGRADPW-UHFFFAOYSA-N |