(3,4-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
(3,4-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
(3,4-dimethoxyphenyl)(4-{[2-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone--oxalic acid (1/1)
Compound characteristics
Compound ID: | 3701-0379 |
Compound Name: | (3,4-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: | COc1ccc(cc1OC)C(N1CCN(CC1)Cc1ccccc1C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 2.8935 |
logD: | 2.892 |
logSw: | -3.3529 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 35.688 |
InChI Key: | ZJFFTSJXPAGQKP-UHFFFAOYSA-N |