N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-4-ethylbenzamide
Chemical Structure Depiction of
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-4-ethylbenzamide
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-4-ethylbenzamide
Compound characteristics
| Compound ID: | T002-4614 |
| Compound Name: | N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-4-ethylbenzamide |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C19 H24 N2 O2 |
| Smiles: | CCc1ccc(cc1)C(NCC1CCN(CC1)C(C#CC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1722 |
| logD: | 3.1722 |
| logSw: | -3.0879 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.044 |
| InChI Key: | YPGQZJWZTHGKBC-UHFFFAOYSA-N |