N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(4-ethylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
Chemical Structure Depiction of
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(4-ethylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(4-ethylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide
Compound characteristics
| Compound ID: | C609-0125 |
| Compound Name: | N~1~-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[1-(4-ethylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]ethanediamide |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C23 H30 N4 O4 S |
| Smiles: | CCN1CCN(CC1)C(C(C)NC(C(NCc1ccc2c(c1)OCO2)=O)=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9848 |
| logD: | 1.3671 |
| logSw: | -2.648 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.195 |
| InChI Key: | KAZOMSNGDQBDIN-UHFFFAOYSA-N |