N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(phenylsulfanyl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(phenylsulfanyl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(phenylsulfanyl)acetamide
Compound characteristics
| Compound ID: | Y030-6800 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(phenylsulfanyl)acetamide |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C16 H15 N O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CSc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9165 |
| logD: | 2.9165 |
| logSw: | -3.2298 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.554 |
| InChI Key: | QLLYJTZWKUZHJX-UHFFFAOYSA-N |