N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-methoxybenzamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-methoxybenzamide
Compound characteristics
Compound ID: | E157-3517 |
Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-4-methoxybenzamide |
Molecular Weight: | 411.44 |
Molecular Formula: | C19 H17 N5 O4 S |
Smiles: | COc1ccc(cc1)C(Nc1nn2c(c3ccc(c(c3)OC)OC)nnc2s1)=O |
Stereo: | ACHIRAL |
logP: | 2.9075 |
logD: | 2.8935 |
logSw: | -3.6137 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.93 |
InChI Key: | VBJZJZJFKFUDFK-UHFFFAOYSA-N |