{4-[(2-bromophenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(2-bromophenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
{4-[(2-bromophenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0162 |
| Compound Name: | {4-[(2-bromophenyl)methyl]piperazin-1-yl}(3-methoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 479.33 |
| Molecular Formula: | C19 H21 Br N2 O2 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cccc(c1)C(N1CCN(CC1)Cc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1531 |
| logD: | 3.1478 |
| logSw: | -3.2303 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9709 |
| InChI Key: | QZTXSZGIMRGIHN-UHFFFAOYSA-N |