(2E)-3-(2,5-dimethoxyphenyl)-N-(2-{4-[methyl(2-methylcyclohexyl)amino]piperidin-1-yl}ethyl)prop-2-enamide--oxalic acid (1/1)
Chemical Structure Depiction of
(2E)-3-(2,5-dimethoxyphenyl)-N-(2-{4-[methyl(2-methylcyclohexyl)amino]piperidin-1-yl}ethyl)prop-2-enamide--oxalic acid (1/1)
(2E)-3-(2,5-dimethoxyphenyl)-N-(2-{4-[methyl(2-methylcyclohexyl)amino]piperidin-1-yl}ethyl)prop-2-enamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | C525-0837 |
| Compound Name: | (2E)-3-(2,5-dimethoxyphenyl)-N-(2-{4-[methyl(2-methylcyclohexyl)amino]piperidin-1-yl}ethyl)prop-2-enamide--oxalic acid (1/1) |
| Molecular Weight: | 533.66 |
| Molecular Formula: | C26 H41 N3 O3 |
| Salt: | HOOCCOOH |
| Smiles: | CC1CCCCC1N(C)C1CCN(CC1)CCNC(/C=C/c1cc(ccc1OC)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4645 |
| logD: | 2.254 |
| logSw: | -4.257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.549 |
| InChI Key: | JBHCMNNNKJNDTL-FMIVXFBMSA-N |