2-{[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
2-{[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Compound characteristics
Compound ID: | G802-1100 |
Compound Name: | 2-{[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide |
Molecular Weight: | 435.5 |
Molecular Formula: | C22 H21 N5 O3 S |
Smiles: | CCOc1ccc(cc1)N1C=Cn2c(C1=O)nnc2SCC(Nc1ccc(C)cc1)=O |
Stereo: | ACHIRAL |
logP: | 2.5282 |
logD: | 2.5282 |
logSw: | -2.8237 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.975 |
InChI Key: | HXDOWQMICVEQRP-UHFFFAOYSA-N |