1,1'-[6-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
1,1'-[6-(3,4-dimethylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
Compound characteristics
Compound ID: | G857-1379 |
Compound Name: | 1,1'-[6-(3,4-dimethylphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one) |
Molecular Weight: | 356.44 |
Molecular Formula: | C18 H20 N4 O2 S |
Smiles: | CCC(C1=C(c2ccc(C)c(C)c2)N(C(CC)=O)n2cnnc2S1)=O |
Stereo: | ACHIRAL |
logP: | 3.2623 |
logD: | 3.2623 |
logSw: | -3.2282 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 55.238 |
InChI Key: | FPSYHFAUAXYXDX-UHFFFAOYSA-N |