1-[(3-fluorophenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(3-fluorophenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
1-[(3-fluorophenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0595 |
| Compound Name: | 1-[(3-fluorophenyl)methyl]-4-[(4-nitrophenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 419.41 |
| Molecular Formula: | C18 H20 F N3 O2 |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1Cc1ccc(cc1)[N+]([O-])=O)Cc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 2.9911 |
| logD: | 2.8512 |
| logSw: | -3.1514 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.893 |
| InChI Key: | HTODTNOGKWVQIH-UHFFFAOYSA-N |