4-(propan-2-yl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-(propan-2-yl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
4-(propan-2-yl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | J011-0008 |
| Compound Name: | 4-(propan-2-yl)-N-{[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 377.47 |
| Molecular Formula: | C20 H19 N5 O S |
| Smiles: | CC(C)c1ccc(cc1)C(NCc1ccc(cc1)c1nn2cnnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.454 |
| logD: | 3.454 |
| logSw: | -3.6705 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.057 |
| InChI Key: | LAEZFPHBJRKEEI-UHFFFAOYSA-N |