{4-[(naphthalen-2-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(naphthalen-2-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
{4-[(naphthalen-2-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0385 |
| Compound Name: | {4-[(naphthalen-2-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 510.54 |
| Molecular Formula: | C25 H28 N2 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CC1)Cc1ccc2ccccc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4446 |
| logD: | 3.4418 |
| logSw: | -3.7261 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.133 |
| InChI Key: | CNVCJJIBVAHGFN-UHFFFAOYSA-N |