2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | E613-0149 |
| Compound Name: | 2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 489.45 |
| Molecular Formula: | C24 H22 F3 N3 O5 |
| Smiles: | C1CN(CCN1C(COCc1cc(c2ccc3c(c2)OCO3)on1)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.779 |
| logD: | 3.779 |
| logSw: | -4.1781 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.2 |
| InChI Key: | VPJOLBPRQFDGQH-UHFFFAOYSA-N |