N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
Chemical Structure Depiction of
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | J011-0062 |
| Compound Name: | N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide |
| Molecular Weight: | 273.31 |
| Molecular Formula: | C12 H11 N5 O S |
| Smiles: | CC(NCc1ccc(cc1)c1nn2cnnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0481 |
| logD: | 0.0481 |
| logSw: | -2.0041 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.228 |
| InChI Key: | CIBNVXJIJYRWJU-UHFFFAOYSA-N |