phenyl{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
Chemical Structure Depiction of
phenyl{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
phenyl{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4092-0543 |
| Compound Name: | phenyl{4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1) |
| Molecular Weight: | 460.48 |
| Molecular Formula: | C21 H26 N2 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(c(cc1CN1CCN(CC1)C(c1ccccc1)=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0454 |
| logD: | 1.8449 |
| logSw: | -2.5644 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.318 |
| InChI Key: | KCEYKNZEZHBUFN-UHFFFAOYSA-N |