3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 4-fluorobenzene-1-sulfonate
3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | Y041-5480 |
| Compound Name: | 3-[(3-methoxyphenoxy)methyl]-1,2-benzoxazol-6-yl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 429.42 |
| Molecular Formula: | C21 H16 F N O6 S |
| Smiles: | COc1cccc(c1)OCc1c2ccc(cc2on1)OS(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6761 |
| logD: | 4.6761 |
| logSw: | -4.6774 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.466 |
| InChI Key: | XWWQSTBBGPTFPV-UHFFFAOYSA-N |