[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | E614-0323 |
| Compound Name: | [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 405.46 |
| Molecular Formula: | C22 H23 N5 O3 |
| Smiles: | Cc1ccc(cc1C)c1cc(C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6211 |
| logD: | 4.6206 |
| logSw: | -4.3715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.018 |
| InChI Key: | MWDXXMNDVDMRGP-UHFFFAOYSA-N |