5-methyl-6-(3-methylbutyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-6-(3-methylbutyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-6-(3-methylbutyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | Y020-2497 |
| Compound Name: | 5-methyl-6-(3-methylbutyl)-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 296.37 |
| Molecular Formula: | C17 H20 N4 O |
| Smiles: | CC(C)CCC1=C(C)Nc2nc(c3ccccc3)nn2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.0254 |
| logD: | 4.0025 |
| logSw: | -4.0604 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.251 |
| InChI Key: | VLMLIZBYNDOMNU-UHFFFAOYSA-N |