2-(4-chlorophenoxy)-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)ethan-1-one
2-(4-chlorophenoxy)-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V001-3047 |
| Compound Name: | 2-(4-chlorophenoxy)-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 500.9 |
| Molecular Formula: | C26 H20 Cl F3 N2 O3 |
| Smiles: | C1CC(c2nc3cc(ccc3o2)c2ccccc2C(F)(F)F)N(C1)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8961 |
| logD: | 5.8961 |
| logSw: | -6.1081 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.457 |
| InChI Key: | XMIPWLLKYZXQAX-QFIPXVFZSA-N |