2-(2,3-dimethylphenoxy)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-(2,3-dimethylphenoxy)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
2-(2,3-dimethylphenoxy)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | J011-0135 |
| Compound Name: | 2-(2,3-dimethylphenoxy)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}acetamide |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C20 H19 N5 O2 S |
| Smiles: | Cc1cccc(c1C)OCC(NCc1ccc(cc1)c1nn2cnnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8856 |
| logD: | 2.8856 |
| logSw: | -3.1279 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.43 |
| InChI Key: | FOWQULXNLAUPIU-UHFFFAOYSA-N |