7-(3,4-dimethylphenyl)-3-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3,4-dimethylphenyl)-3-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3,4-dimethylphenyl)-3-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0617 |
| Compound Name: | 7-(3,4-dimethylphenyl)-3-{[(4-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | Cc1ccc(CSc2nnc3C(N(C=Cn23)c2ccc(C)c(C)c2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6314 |
| logD: | 3.6314 |
| logSw: | -3.6161 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | LARIUUTVDKKWPT-UHFFFAOYSA-N |