1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethan-1-one
1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 2023-0170 |
| Compound Name: | 1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 264.28 |
| Molecular Formula: | C12 H16 N4 O3 |
| Smiles: | CC(N1CCN(CC1)c1ccc(c(c1)N)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9201 |
| logD: | 0.9201 |
| logSw: | -1.9157 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.063 |
| InChI Key: | KYSIZBKIGWHFKZ-UHFFFAOYSA-N |