8-[(2-ethylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
8-[(2-ethylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
8-[(2-ethylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | M451-2605 |
| Compound Name: | 8-[(2-ethylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C25 H26 N6 O2 S |
| Smiles: | CCc1ccccc1SC1C2=NN(CC(N3CCN(CC3)c3ccccc3)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0065 |
| logD: | 3.0064 |
| logSw: | -3.0434 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.09 |
| InChI Key: | SARPCZSGKWGZGO-UHFFFAOYSA-N |