7-(3,4-difluorophenyl)-3-{[(2,5-dimethylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3,4-difluorophenyl)-3-{[(2,5-dimethylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3,4-difluorophenyl)-3-{[(2,5-dimethylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-1037 |
| Compound Name: | 7-(3,4-difluorophenyl)-3-{[(2,5-dimethylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 398.43 |
| Molecular Formula: | C20 H16 F2 N4 O S |
| Smiles: | Cc1ccc(C)c(CSc2nnc3C(N(C=Cn23)c2ccc(c(c2)F)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9486 |
| logD: | 3.9486 |
| logSw: | -3.8331 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | WMWUMUNUZGOQQU-UHFFFAOYSA-N |