(2,6-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
(2,6-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
(2,6-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0308 |
| Compound Name: | (2,6-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 498.45 |
| Molecular Formula: | C21 H23 F3 N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cccc(c1C(N1CCN(CC1)Cc1ccccc1C(F)(F)F)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9165 |
| logD: | 2.9149 |
| logSw: | -3.3724 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.688 |
| InChI Key: | QKASSONCRIQFQE-UHFFFAOYSA-N |