N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}pyridine-3-carboxamide
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | J011-0100 |
| Compound Name: | N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}pyridine-3-carboxamide |
| Molecular Weight: | 336.37 |
| Molecular Formula: | C16 H12 N6 O S |
| Smiles: | C(c1ccc(cc1)c1nn2cnnc2s1)NC(c1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9278 |
| logD: | 0.9277 |
| logSw: | -1.5287 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.575 |
| InChI Key: | HASAAVUSLWFUEB-UHFFFAOYSA-N |