8-(cyclohexylsulfanyl)-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-(cyclohexylsulfanyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
8-(cyclohexylsulfanyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | M451-2457 |
| Compound Name: | 8-(cyclohexylsulfanyl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 452.58 |
| Molecular Formula: | C23 H28 N6 O2 S |
| Smiles: | C1CCC(CC1)SC1C2=NN(CC(N3CCN(CC3)c3ccccc3)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7722 |
| logD: | 2.7721 |
| logSw: | -2.8958 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.282 |
| InChI Key: | HDOILBKPHAGTTF-UHFFFAOYSA-N |