{4-[(1H-indol-3-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Chemical Structure Depiction of
{4-[(1H-indol-3-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
{4-[(1H-indol-3-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4964-1277 |
| Compound Name: | {4-[(1H-indol-3-yl)methyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone--oxalic acid (1/1) |
| Molecular Weight: | 499.52 |
| Molecular Formula: | C23 H27 N3 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CC1)Cc1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3296 |
| logD: | 2.063 |
| logSw: | -3.0857 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.276 |
| InChI Key: | FBAIWUFOUWHOSJ-UHFFFAOYSA-N |