{4-[(2-bromophenyl)methyl]piperazin-1-yl}{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone
Chemical Structure Depiction of
{4-[(2-bromophenyl)methyl]piperazin-1-yl}{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone
{4-[(2-bromophenyl)methyl]piperazin-1-yl}{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | Y500-4449 |
| Compound Name: | {4-[(2-bromophenyl)methyl]piperazin-1-yl}{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone |
| Molecular Weight: | 484.35 |
| Molecular Formula: | C22 H22 Br N5 O3 |
| Smiles: | C1CN(CCN1Cc1ccccc1[Br])C(c1ccc(Cn2cc(cn2)[N+]([O-])=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7577 |
| logD: | 2.7524 |
| logSw: | -2.8368 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.314 |
| InChI Key: | ZDIXAKYRAGGCNI-UHFFFAOYSA-N |