2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-0434 |
| Compound Name: | 2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 433.4 |
| Molecular Formula: | C21 H14 F3 N O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc2c(c1)nc(c1ccccc1OS(c1cccc(c1)C(F)(F)F)(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.3548 |
| logD: | 5.3548 |
| logSw: | -5.6914 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.897 |
| InChI Key: | CHZCZTXLEAAPGM-UHFFFAOYSA-N |