1-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2,2-diphenylethan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2,2-diphenylethan-1-one--oxalic acid (1/1)
1-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2,2-diphenylethan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3701-0120 |
| Compound Name: | 1-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2,2-diphenylethan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C25 H25 F N2 O |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1Cc1ccc(cc1)F)C(C(c1ccccc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2771 |
| logD: | 4.2599 |
| logSw: | -4.2247 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.1556 |
| InChI Key: | ROCSQNCAJXSRKE-UHFFFAOYSA-N |