2-(4-methylphenoxy)-1-{2-[5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenoxy)-1-{2-[5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
2-(4-methylphenoxy)-1-{2-[5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | M754-1649 |
| Compound Name: | 2-(4-methylphenoxy)-1-{2-[5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C20 H22 N6 O2 |
| Smiles: | Cc1ccc(cc1)OCC(N1CCCCC1c1nnc(c2cnccn2)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4867 |
| logD: | 1.4162 |
| logSw: | -1.3182 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.631 |
| InChI Key: | NKYSJJGPHBAKES-KRWDZBQOSA-N |