3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0047 |
| Compound Name: | 3-{[(4-ethenylphenyl)methyl]sulfanyl}-7-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C20 H15 F N4 O S |
| Smiles: | C=Cc1ccc(CSc2nnc3C(N(C=Cn23)c2cccc(c2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7454 |
| logD: | 2.7454 |
| logSw: | -2.9965 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | GQOAOSAPIXZFBB-UHFFFAOYSA-N |