1-[(4-methoxynaphthalen-1-yl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4-methoxynaphthalen-1-yl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
1-[(4-methoxynaphthalen-1-yl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0677 |
| Compound Name: | 1-[(4-methoxynaphthalen-1-yl)methyl]-4-[(3-nitrophenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C23 H25 N3 O3 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CN2CCN(CC2)Cc2cccc(c2)[N+]([O-])=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.1046 |
| logD: | 4.074 |
| logSw: | -4.3615 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.252 |
| InChI Key: | BFRDBRBGAXZPIF-UHFFFAOYSA-N |