4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3-methylbutyl)butanamide
Chemical Structure Depiction of
4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3-methylbutyl)butanamide
4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3-methylbutyl)butanamide
Compound characteristics
Compound ID: | G423-0433 |
Compound Name: | 4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3-methylbutyl)butanamide |
Molecular Weight: | 411.5 |
Molecular Formula: | C22 H29 N5 O3 |
Smiles: | CCOc1ccc(cc1)N1C=Cn2c(CCCC(NCCC(C)C)=O)nnc2C1=O |
Stereo: | ACHIRAL |
logP: | 1.1452 |
logD: | 1.1452 |
logSw: | -2.1418 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.805 |
InChI Key: | KYPFTTVVMCCVPG-UHFFFAOYSA-N |