{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
{4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0269 |
| Compound Name: | {4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 509.35 |
| Molecular Formula: | C20 H23 Br N2 O3 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cccc(c1)C(N1CCN(CC1)Cc1cc(ccc1OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1744 |
| logD: | 3.1581 |
| logSw: | -3.231 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.601 |
| InChI Key: | MDKUYGFRSWBMPO-UHFFFAOYSA-N |