4-benzyl-5-methyl-6-[2-oxo-2-(piperidin-1-yl)ethyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
4-benzyl-5-methyl-6-[2-oxo-2-(piperidin-1-yl)ethyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
4-benzyl-5-methyl-6-[2-oxo-2-(piperidin-1-yl)ethyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D584-0207 |
| Compound Name: | 4-benzyl-5-methyl-6-[2-oxo-2-(piperidin-1-yl)ethyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C26 H27 N5 O2 |
| Smiles: | [H]C([H])(c1ccccc1)N1C(C)=C(CC(N2CCCCC2)=O)C(n2c1nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2623 |
| logD: | 4.2623 |
| logSw: | -4.2125 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.604 |
| InChI Key: | BWLXQYGWLAAIRV-UHFFFAOYSA-N |