3-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
Chemical Structure Depiction of
3-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
3-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V022-8617 |
| Compound Name: | 3-(5-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate |
| Molecular Weight: | 449.4 |
| Molecular Formula: | C21 H14 F3 N O5 S |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(c1)OS(c1ccccc1OC(F)(F)F)(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.8361 |
| logD: | 5.8361 |
| logSw: | -5.7234 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.834 |
| InChI Key: | XELRYRMMCUJPAK-UHFFFAOYSA-N |