1-{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxypropan-1-one
Chemical Structure Depiction of
1-{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxypropan-1-one
1-{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxypropan-1-one
Compound characteristics
| Compound ID: | S517-0930 |
| Compound Name: | 1-{4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxypropan-1-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | CC(C(N1CCC(CC1)Cc1nncn1Cc1ccccc1)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3225 |
| logD: | 3.3224 |
| logSw: | -3.4703 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.737 |
| InChI Key: | FNNBFIGAELWEGI-IBGZPJMESA-N |