[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(phenylmethanesulfonyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(phenylmethanesulfonyl)piperazin-1-yl]methanone
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(phenylmethanesulfonyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | E687-0249 |
| Compound Name: | [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl][4-(phenylmethanesulfonyl)piperazin-1-yl]methanone |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1C)c1cc(C(N2CCN(CC2)S(Cc2ccccc2)(=O)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6008 |
| logD: | 3.6003 |
| logSw: | -3.7964 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.79 |
| InChI Key: | KXVZCBRLZZBAPF-UHFFFAOYSA-N |