3-benzyl-1,2-benzoxazol-6-yl benzenesulfonate
Chemical Structure Depiction of
3-benzyl-1,2-benzoxazol-6-yl benzenesulfonate
3-benzyl-1,2-benzoxazol-6-yl benzenesulfonate
Compound characteristics
| Compound ID: | Y041-5470 |
| Compound Name: | 3-benzyl-1,2-benzoxazol-6-yl benzenesulfonate |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C20 H15 N O4 S |
| Smiles: | C(c1ccccc1)c1c2ccc(cc2on1)OS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5032 |
| logD: | 4.5032 |
| logSw: | -4.5919 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.423 |
| InChI Key: | VGKYEJDRHQTVFC-UHFFFAOYSA-N |