5-[(azepan-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-[(azepan-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-[(azepan-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D351-0023 |
| Compound Name: | 5-[(azepan-1-yl)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 323.4 |
| Molecular Formula: | C18 H21 N5 O |
| Smiles: | C1CCCN(CC1)CC1=CC(n2c(N1)nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7792 |
| logD: | 1.748 |
| logSw: | -3.2106 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.404 |
| InChI Key: | VTNIQYPVLADCDL-UHFFFAOYSA-N |