3-({4-[(4-bromophenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
Chemical Structure Depiction of
3-({4-[(4-bromophenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
3-({4-[(4-bromophenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-0630 |
| Compound Name: | 3-({4-[(4-bromophenyl)methyl]piperazin-1-yl}methyl)-1H-indole--oxalic acid (1/1) |
| Molecular Weight: | 474.35 |
| Molecular Formula: | C20 H22 Br N3 |
| Salt: | HOOCCOOH |
| Smiles: | C1CN(CCN1Cc1ccc(cc1)[Br])Cc1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9735 |
| logD: | 2.8342 |
| logSw: | -4.1804 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 17.3822 |
| InChI Key: | WCGNEUNDEPMGTB-UHFFFAOYSA-N |