N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromo-2-ethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromo-2-ethoxybenzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromo-2-ethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5707-1236 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-bromo-2-ethoxybenzene-1-sulfonamide |
| Molecular Weight: | 414.27 |
| Molecular Formula: | C16 H16 Br N O5 S |
| Smiles: | CCOc1ccc(cc1S(NCc1ccc2c(c1)OCO2)(=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.7277 |
| logD: | 3.7276 |
| logSw: | -3.888 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.322 |
| InChI Key: | HWMLWOJHAZPJOU-UHFFFAOYSA-N |