1-[(4-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(4-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-[(4-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0925 |
| Compound Name: | 1-[(4-nitrophenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 491.5 |
| Molecular Formula: | C21 H27 N3 O5 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(CN2CCN(CC2)Cc2ccc(cc2)[N+]([O-])=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5303 |
| logD: | 0.1594 |
| logSw: | -2.735 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.871 |
| InChI Key: | JWTLKFZNBODQRY-UHFFFAOYSA-N |