{4-[(3-fluorophenyl)methyl]piperazin-1-yl}(4-nitro-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
{4-[(3-fluorophenyl)methyl]piperazin-1-yl}(4-nitro-1H-pyrazol-3-yl)methanone
{4-[(3-fluorophenyl)methyl]piperazin-1-yl}(4-nitro-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y502-3578 |
| Compound Name: | {4-[(3-fluorophenyl)methyl]piperazin-1-yl}(4-nitro-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 333.32 |
| Molecular Formula: | C15 H16 F N5 O3 |
| Smiles: | C1CN(CCN1Cc1cccc(c1)F)C(c1c(c[nH]n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2764 |
| logD: | 1.2307 |
| logSw: | -2.2798 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.969 |
| InChI Key: | VHHDGPYDHQECHS-UHFFFAOYSA-N |