N~1~-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-N~2~-(2-cyanophenyl)ethanediamide
Chemical Structure Depiction of
N~1~-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-N~2~-(2-cyanophenyl)ethanediamide
N~1~-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-N~2~-(2-cyanophenyl)ethanediamide
Compound characteristics
| Compound ID: | G856-4203 |
| Compound Name: | N~1~-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-N~2~-(2-cyanophenyl)ethanediamide |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C28 H27 N5 O4 |
| Smiles: | C(C(c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccccc1)NC(C(Nc1ccccc1C#N)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2298 |
| logD: | 1.1314 |
| logSw: | -3.6897 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.738 |
| InChI Key: | VKPBEPBZCIVKGY-DEOSSOPVSA-N |