N-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-3-methylbenzamide
Chemical Structure Depiction of
N-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-3-methylbenzamide
N-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-3-methylbenzamide
Compound characteristics
| Compound ID: | E157-3456 |
| Compound Name: | N-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-3-methylbenzamide |
| Molecular Weight: | 287.34 |
| Molecular Formula: | C13 H13 N5 O S |
| Smiles: | CCc1nnc2n1nc(NC(c1cccc(C)c1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.2675 |
| logD: | 1.555 |
| logSw: | -2.8456 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.373 |
| InChI Key: | GCWAWFIDIUAZMM-UHFFFAOYSA-N |