3,3-dimethyl-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)butan-1-one
Chemical Structure Depiction of
3,3-dimethyl-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)butan-1-one
3,3-dimethyl-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)butan-1-one
Compound characteristics
| Compound ID: | V007-6927 |
| Compound Name: | 3,3-dimethyl-1-(2-{5-[2-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}pyrrolidin-1-yl)butan-1-one |
| Molecular Weight: | 430.47 |
| Molecular Formula: | C24 H25 F3 N2 O2 |
| Smiles: | CC(C)(C)CC(N1CCCC1c1nc2cc(ccc2o1)c1ccccc1C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7856 |
| logD: | 5.7856 |
| logSw: | -5.4616 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.229 |
| InChI Key: | UKVQYGUQGMZFRC-IBGZPJMESA-N |