7-(2-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(2-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(2-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0189 |
| Compound Name: | 7-(2-methoxyphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cc1cccc(CSc2nnc3C(N(C=Cn23)c2ccccc2OC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8898 |
| logD: | 2.8898 |
| logSw: | -3.2675 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.032 |
| InChI Key: | XRPAHHMQNRHQIL-UHFFFAOYSA-N |