N-[1-(but-2-ynoyl)piperidin-4-yl]-3,4-difluorobenzamide
Chemical Structure Depiction of
N-[1-(but-2-ynoyl)piperidin-4-yl]-3,4-difluorobenzamide
N-[1-(but-2-ynoyl)piperidin-4-yl]-3,4-difluorobenzamide
Compound characteristics
| Compound ID: | T002-3466 |
| Compound Name: | N-[1-(but-2-ynoyl)piperidin-4-yl]-3,4-difluorobenzamide |
| Molecular Weight: | 306.31 |
| Molecular Formula: | C16 H16 F2 N2 O2 |
| Smiles: | CC#CC(N1CCC(CC1)NC(c1ccc(c(c1)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2317 |
| logD: | 2.2317 |
| logSw: | -2.7087 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.577 |
| InChI Key: | BZMOLBXCYUWMGP-UHFFFAOYSA-N |