5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
Compound ID: | V008-7952 |
Compound Name: | 5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
Molecular Weight: | 467.85 |
Molecular Formula: | C21 H13 Cl F3 N O4 S |
Smiles: | Cc1ccc2c(c1)nc(c1ccc(cc1OS(c1cccc(c1)C(F)(F)F)(=O)=O)[Cl])o2 |
Stereo: | ACHIRAL |
logP: | 6.3054 |
logD: | 6.3054 |
logSw: | -6.4357 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.897 |
InChI Key: | ZOXGMKGVOLTUNM-UHFFFAOYSA-N |