5-methyl-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D475-1603 |
| Compound Name: | 5-methyl-4-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C22 H22 N6 O2 S |
| Smiles: | CC1=CC(n2c(nc(c3cccs3)n2)N1CC(N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6438 |
| logD: | 2.6438 |
| logSw: | -2.9206 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.016 |
| InChI Key: | ANDROPKSGPXODB-UHFFFAOYSA-N |