{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(phenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(phenyl)methanone--oxalic acid (1/1)
{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(phenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0287 |
| Compound Name: | {4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(phenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 479.33 |
| Molecular Formula: | C19 H21 Br N2 O2 |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(cc1CN1CCN(CC1)C(c1ccccc1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0912 |
| logD: | 3.0749 |
| logSw: | -3.1894 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.0576 |
| InChI Key: | HEGRZOKLHUUKRH-UHFFFAOYSA-N |