3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-phenyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-phenyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-phenyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0554 |
| Compound Name: | 3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-phenyl[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 360.44 |
| Molecular Formula: | C20 H16 N4 O S |
| Smiles: | C=Cc1ccc(CSc2nnc3C(N(C=Cn23)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5332 |
| logD: | 2.5332 |
| logSw: | -2.5962 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | HNWHQAZJQTVIGL-UHFFFAOYSA-N |