N-{5-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{5-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
N-{5-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | Y043-4853 |
| Compound Name: | N-{5-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(pyrimidin-2-yl)piperidine-3-carboxamide |
| Molecular Weight: | 399.4 |
| Molecular Formula: | C19 H19 F2 N7 O |
| Smiles: | C1CC(CN(C1)c1ncccn1)C(Nc1nc(Cc2cc(cc(c2)F)F)[nH]n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0644 |
| logD: | 3.042 |
| logSw: | -3.1353 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.987 |
| InChI Key: | ODLQZKKUKWGVPL-ZDUSSCGKSA-N |