7-(3,4-difluorophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3,4-difluorophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3,4-difluorophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-1020 |
| Compound Name: | 7-(3,4-difluorophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 440.47 |
| Molecular Formula: | C22 H18 F2 N4 O2 S |
| Smiles: | CC(C(c1ccc(C)c(C)c1)=O)Sc1nnc2C(N(C=Cn12)c1ccc(c(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9506 |
| logD: | 3.9506 |
| logSw: | -4.0247 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.441 |
| InChI Key: | ZTYQTEZAEDOQQT-AWEZNQCLSA-N |