N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(propylsulfanyl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(propylsulfanyl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(propylsulfanyl)benzamide
Compound characteristics
| Compound ID: | Y031-2777 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(propylsulfanyl)benzamide |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C18 H19 N O3 S |
| Smiles: | CCCSc1ccccc1C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1221 |
| logD: | 4.1221 |
| logSw: | -4.1936 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.767 |
| InChI Key: | PNWZLRRIYIJTAJ-UHFFFAOYSA-N |