1-(4-benzylpiperazin-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one
Chemical Structure Depiction of
1-(4-benzylpiperazin-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one
1-(4-benzylpiperazin-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y032-3093 |
| Compound Name: | 1-(4-benzylpiperazin-1-yl)-3-(2-nitrophenyl)prop-2-en-1-one |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(/C=C/c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8157 |
| logD: | 2.8011 |
| logSw: | -3.1731 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.98 |
| InChI Key: | BXKHMHZEBAUFHU-UHFFFAOYSA-N |