2-phenyl-1-(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)ethan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
2-phenyl-1-(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)ethan-1-one--oxalic acid (1/1)
2-phenyl-1-(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)ethan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-2544 |
| Compound Name: | 2-phenyl-1-(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)ethan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 452.43 |
| Molecular Formula: | C20 H21 F3 N2 O |
| Salt: | HOOCCOOH |
| Smiles: | C(C(N1CCN(CC1)Cc1ccccc1C(F)(F)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6327 |
| logD: | 3.6297 |
| logSw: | -3.9136 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.8998 |
| InChI Key: | CIRDNPXRJOOTJH-UHFFFAOYSA-N |