1-[3-nitro-4-(piperazin-1-yl)phenyl]ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[3-nitro-4-(piperazin-1-yl)phenyl]ethan-1-one--hydrogen chloride (1/1)
1-[3-nitro-4-(piperazin-1-yl)phenyl]ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8020-5745 |
| Compound Name: | 1-[3-nitro-4-(piperazin-1-yl)phenyl]ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 285.73 |
| Molecular Formula: | C12 H15 N3 O3 |
| Salt: | HCl |
| Smiles: | CC(c1ccc(c(c1)[N+]([O-])=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7039 |
| logD: | -0.4747 |
| logSw: | -2.1147 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.258 |
| InChI Key: | GHEDOFZBDHZHEP-UHFFFAOYSA-N |