2-(5-methyl-1,2-benzoxazol-3-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(5-methyl-1,2-benzoxazol-3-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-(5-methyl-1,2-benzoxazol-3-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | E207-0756 |
| Compound Name: | 2-(5-methyl-1,2-benzoxazol-3-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H20 F3 N3 O2 |
| Smiles: | Cc1ccc2c(c1)c(CC(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 4.2611 |
| logD: | 4.2611 |
| logSw: | -4.4234 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.314 |
| InChI Key: | MRPFMGLWIJEQTD-UHFFFAOYSA-N |