1-{[6-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
1-{[6-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
1-{[6-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D064-0326 |
| Compound Name: | 1-{[6-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole |
| Molecular Weight: | 346.41 |
| Molecular Formula: | C18 H14 N6 S |
| Smiles: | Cc1ccc(cc1)c1nn2c(Cn3cnc4ccccc34)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8498 |
| logD: | 1.7333 |
| logSw: | -2.9032 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.154 |
| InChI Key: | KGMZHDLNBVOKSR-UHFFFAOYSA-N |