1-{[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
1-{[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
1-{[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D064-0341 |
| Compound Name: | 1-{[6-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole |
| Molecular Weight: | 392.44 |
| Molecular Formula: | C19 H16 N6 O2 S |
| Smiles: | COc1ccc(cc1OC)c1nn2c(Cn3cnc4ccccc34)nnc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.0315 |
| logD: | 0.915 |
| logSw: | -2.4115 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.415 |
| InChI Key: | LGPPSCUPBQPAGU-UHFFFAOYSA-N |