N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-[2-(4-benzylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]ethanediamide
Chemical Structure Depiction of
N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-[2-(4-benzylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]ethanediamide
N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-[2-(4-benzylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]ethanediamide
Compound characteristics
| Compound ID: | E155-0739 |
| Compound Name: | N~1~-(2H-1,3-benzodioxol-5-yl)-N~2~-[2-(4-benzylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]ethanediamide |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C27 H29 N5 O4 |
| Smiles: | C(C(c1cccnc1)N1CCN(CC1)Cc1ccccc1)NC(C(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7952 |
| logD: | 1.0469 |
| logSw: | -1.9643 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.178 |
| InChI Key: | VSWBNLDPPONRHH-QHCPKHFHSA-N |