{4-[(3-methylphenyl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(3-methylphenyl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
{4-[(3-methylphenyl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0378 |
| Compound Name: | {4-[(3-methylphenyl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 474.51 |
| Molecular Formula: | C22 H28 N2 O4 |
| Salt: | HOOCCOOH |
| Smiles: | Cc1cccc(CN2CCN(CC2)C(c2cc(c(c(c2)OC)OC)OC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7799 |
| logD: | 2.7489 |
| logSw: | -2.9167 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.405 |
| InChI Key: | LTXPFWVDWUYKGW-UHFFFAOYSA-N |