N-(2H-1,3-benzodioxol-5-yl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(phenylmethanesulfonyl)propanamide
N-(2H-1,3-benzodioxol-5-yl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y031-1293 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C17 H17 N O5 S |
| Smiles: | C(CS(Cc1ccccc1)(=O)=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6854 |
| logD: | 1.6851 |
| logSw: | -2.4524 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.532 |
| InChI Key: | DGVPGHRQVFIIRS-UHFFFAOYSA-N |