3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}propanamide
3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | Y300-0809 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}propanamide |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C22 H27 N3 O3 |
| Smiles: | CN1CCN(CC1)c1ccc(CNC(CCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6082 |
| logD: | 2.0401 |
| logSw: | -3.0608 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.483 |
| InChI Key: | VRFHHBXZYYXRCN-UHFFFAOYSA-N |