1,1'-[6-(4-ethoxyphenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
Chemical Structure Depiction of
1,1'-[6-(4-ethoxyphenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
1,1'-[6-(4-ethoxyphenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
Compound characteristics
Compound ID: | G857-1371 |
Compound Name: | 1,1'-[6-(4-ethoxyphenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one) |
Molecular Weight: | 400.5 |
Molecular Formula: | C20 H24 N4 O3 S |
Smiles: | CCC(C1=C(c2ccc(cc2)OCC)N(C(CC)=O)n2c(CC)nnc2S1)=O |
Stereo: | ACHIRAL |
logP: | 3.3653 |
logD: | 3.3653 |
logSw: | -3.424 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.211 |
InChI Key: | VWWSWPWYZFZRMM-UHFFFAOYSA-N |