N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(4-ethoxyphenyl)acetamide
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | T002-4729 |
| Compound Name: | N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-2-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C20 H26 N2 O3 |
| Smiles: | CCOc1ccc(CC(NCC2CCN(CC2)C(C#CC)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4008 |
| logD: | 2.4008 |
| logSw: | -2.572 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.954 |
| InChI Key: | GAVHPSCSSLTQHT-UHFFFAOYSA-N |