N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(3,4-diethoxyphenyl)acetamide
Chemical Structure Depiction of
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(3,4-diethoxyphenyl)acetamide
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(3,4-diethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | T002-4839 |
| Compound Name: | N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(3,4-diethoxyphenyl)acetamide |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C22 H30 N2 O4 |
| Smiles: | CCOc1ccc(CC(NCC2CCN(CC2)C(C#CC)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.1416 |
| logD: | 2.1416 |
| logSw: | -2.6995 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.251 |
| InChI Key: | OXYURRQGTOMZMC-UHFFFAOYSA-N |