1-{4-[4-fluoro-2-nitro-5-(piperidin-1-yl)phenyl]piperazin-1-yl}butan-1-one
Chemical Structure Depiction of
1-{4-[4-fluoro-2-nitro-5-(piperidin-1-yl)phenyl]piperazin-1-yl}butan-1-one
1-{4-[4-fluoro-2-nitro-5-(piperidin-1-yl)phenyl]piperazin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | 3756-0022 |
| Compound Name: | 1-{4-[4-fluoro-2-nitro-5-(piperidin-1-yl)phenyl]piperazin-1-yl}butan-1-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C19 H27 F N4 O3 |
| Smiles: | CCCC(N1CCN(CC1)c1cc(c(cc1[N+]([O-])=O)F)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5122 |
| logD: | 3.5122 |
| logSw: | -3.9914 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.822 |
| InChI Key: | JGJOYBLUYUYVKF-UHFFFAOYSA-N |