3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}propanamide
3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | Y300-2247 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}propanamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C21 H24 N2 O3 |
| Smiles: | C1CCN(C1)c1ccc(CNC(CCc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6696 |
| logD: | 3.669 |
| logSw: | -3.8742 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.372 |
| InChI Key: | YSWOUGQQZYYGHA-UHFFFAOYSA-N |