1-{4-[(4-ethylphenyl)methyl]piperazin-1-yl}-3-methylbutan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-ethylphenyl)methyl]piperazin-1-yl}-3-methylbutan-1-one--oxalic acid (1/1)
1-{4-[(4-ethylphenyl)methyl]piperazin-1-yl}-3-methylbutan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4092-0342 |
| Compound Name: | 1-{4-[(4-ethylphenyl)methyl]piperazin-1-yl}-3-methylbutan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C18 H28 N2 O |
| Salt: | HOOCCOOH |
| Smiles: | CCc1ccc(CN2CCN(CC2)C(CC(C)C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.31 |
| logD: | 3.2049 |
| logSw: | -3.3021 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.1713 |
| InChI Key: | HOWCWBHKPQEDID-UHFFFAOYSA-N |