{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(2,5-difluorophenyl)methanone
Chemical Structure Depiction of
{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(2,5-difluorophenyl)methanone
{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(2,5-difluorophenyl)methanone
Compound characteristics
| Compound ID: | S517-0894 |
| Compound Name: | {4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(2,5-difluorophenyl)methanone |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C22 H22 F2 N4 O |
| Smiles: | C1CN(CCC1Cc1nncn1Cc1ccccc1)C(c1cc(ccc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3992 |
| logD: | 3.399 |
| logSw: | -3.8319 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.948 |
| InChI Key: | LUZHEHXCBUFMOH-UHFFFAOYSA-N |