2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
Compound ID: | L850-0166 |
Compound Name: | 2-({4-ethyl-5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide |
Molecular Weight: | 428.51 |
Molecular Formula: | C20 H24 N6 O3 S |
Smiles: | CCn1c(c2nc(c3cccc(C)c3)no2)nnc1SCC(NCC1CCCO1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6092 |
logD: | 2.6092 |
logSw: | -2.7617 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.769 |
InChI Key: | ZQVMJVAOBPUUSH-OAHLLOKOSA-N |