N-{[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}-3-methoxybenzamide
N-{[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}-3-methoxybenzamide
Compound characteristics
Compound ID: | J011-0334 |
Compound Name: | N-{[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}-3-methoxybenzamide |
Molecular Weight: | 393.47 |
Molecular Formula: | C20 H19 N5 O2 S |
Smiles: | CCc1nnc2n1nc(c1ccc(CNC(c3cccc(c3)OC)=O)cc1)s2 |
Stereo: | ACHIRAL |
logP: | 2.8626 |
logD: | 2.8626 |
logSw: | -3.363 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.926 |
InChI Key: | KWGYSVJAYQGDKF-UHFFFAOYSA-N |