2-(4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}piperazin-1-yl)-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}piperazin-1-yl)-N-(4-ethoxyphenyl)acetamide
2-(4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}piperazin-1-yl)-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K940-1901 |
| Compound Name: | 2-(4-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}piperazin-1-yl)-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C23 H28 N4 O5 |
| Smiles: | CCOc1ccc(cc1)NC(CN1CCN(CC1)CC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2691 |
| logD: | 3.2686 |
| logSw: | -3.3064 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.049 |
| InChI Key: | HXTUAGHRPFUIHT-UHFFFAOYSA-N |