N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | J011-0001 |
| Compound Name: | N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 335.39 |
| Molecular Formula: | C17 H13 N5 O S |
| Smiles: | C(c1ccc(cc1)c1nn2cnnc2s1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0108 |
| logD: | 2.0108 |
| logSw: | -2.442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.057 |
| InChI Key: | AXZCUVSDCCDYHH-UHFFFAOYSA-N |