{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4-nitrophenyl)methanone
Chemical Structure Depiction of
{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4-nitrophenyl)methanone
{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4-nitrophenyl)methanone
Compound characteristics
| Compound ID: | Y502-1477 |
| Compound Name: | {4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}(4-nitrophenyl)methanone |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C18 H23 N5 O3 |
| Smiles: | CCn1c(C)c(CN2CCN(CC2)C(c2ccc(cc2)[N+]([O-])=O)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.2838 |
| logD: | -1.7032 |
| logSw: | -2.0424 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.734 |
| InChI Key: | SLXTWVGPZPGRFE-UHFFFAOYSA-N |