2-(3,4-dimethylphenoxy)-N-[3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-[3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
2-(3,4-dimethylphenoxy)-N-[3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Compound characteristics
Compound ID: | G952-1270 |
Compound Name: | 2-(3,4-dimethylphenoxy)-N-[3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide |
Molecular Weight: | 393.47 |
Molecular Formula: | C20 H19 N5 O2 S |
Smiles: | Cc1ccc(cc1)c1nnc2n1nc(NC(COc1ccc(C)c(C)c1)=O)s2 |
Stereo: | ACHIRAL |
logP: | 4.6971 |
logD: | 4.6961 |
logSw: | -4.4116 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.411 |
InChI Key: | MTBFSGTYPXRUEH-UHFFFAOYSA-N |