8-[(3-methylphenyl)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-[(3-methylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
8-[(3-methylphenyl)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: | M451-0860 |
| Compound Name: | 8-[(3-methylphenyl)sulfanyl]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 460.56 |
| Molecular Formula: | C24 H24 N6 O2 S |
| Smiles: | Cc1cccc(c1)SC1C2=NN(CC(N3CCN(CC3)c3ccccc3)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6244 |
| logD: | 2.6243 |
| logSw: | -2.8803 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.09 |
| InChI Key: | UZSDFNFMWHKAAF-UHFFFAOYSA-N |