3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
Chemical Structure Depiction of
3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V007-7744 |
| Compound Name: | 3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl 2-(trifluoromethoxy)benzene-1-sulfonate |
| Molecular Weight: | 527.49 |
| Molecular Formula: | C22 H16 F3 N O7 S2 |
| Smiles: | CCS(c1ccc2c(c1)nc(c1cccc(c1)OS(c1ccccc1OC(F)(F)F)(=O)=O)o2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6662 |
| logD: | 4.6662 |
| logSw: | -4.6031 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.87 |
| InChI Key: | ZFFVILRDKYEIAS-UHFFFAOYSA-N |