2-(1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-(1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-(1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V015-5119 |
| Compound Name: | 2-(1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 419.38 |
| Molecular Formula: | C20 H12 F3 N O4 S |
| Smiles: | c1ccc(c(c1)c1nc2ccccc2o1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1394 |
| logD: | 5.1394 |
| logSw: | -5.561 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.897 |
| InChI Key: | ZKSPIKNCONIIRU-UHFFFAOYSA-N |