3-(2H-1,3-benzodioxol-5-yl)-1-(4-ethylpiperazin-1-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-1-(4-ethylpiperazin-1-yl)prop-2-en-1-one
3-(2H-1,3-benzodioxol-5-yl)-1-(4-ethylpiperazin-1-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y032-2074 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-1-(4-ethylpiperazin-1-yl)prop-2-en-1-one |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C16 H20 N2 O3 |
| Smiles: | CCN1CCN(CC1)C(/C=C/c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9655 |
| logD: | 1.7978 |
| logSw: | -2.3399 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.012 |
| InChI Key: | NRCKMILNOSXQBK-UHFFFAOYSA-N |