1-(adamantan-2-yl)-4-{[2-(trifluoromethyl)phenyl]methyl}piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-(adamantan-2-yl)-4-{[2-(trifluoromethyl)phenyl]methyl}piperazine--oxalic acid (1/1)
1-(adamantan-2-yl)-4-{[2-(trifluoromethyl)phenyl]methyl}piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4092-0898 |
| Compound Name: | 1-(adamantan-2-yl)-4-{[2-(trifluoromethyl)phenyl]methyl}piperazine--oxalic acid (1/1) |
| Molecular Weight: | 468.52 |
| Molecular Formula: | C22 H29 F3 N2 |
| Salt: | HOOCCOOH |
| Smiles: | C1C2CC3CC1CC(C2)C3N1CCN(CC1)Cc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.1827 |
| logD: | 4.791 |
| logSw: | -5.5709 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 5.8363 |
| InChI Key: | AHNGZRXQNOSBIN-UHFFFAOYSA-N |