N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propanamide
Chemical Structure Depiction of
N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propanamide
N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propanamide
Compound characteristics
| Compound ID: | E157-4187 |
| Compound Name: | N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propanamide |
| Molecular Weight: | 287.34 |
| Molecular Formula: | C13 H13 N5 O S |
| Smiles: | CCC(Nc1nn2c(c3ccccc3C)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1645 |
| logD: | 2.1636 |
| logSw: | -2.8717 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.183 |
| InChI Key: | BABSMDCOMDHPDG-UHFFFAOYSA-N |