3-benzyl-6-(3,4-dimethylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-benzyl-6-(3,4-dimethylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
3-benzyl-6-(3,4-dimethylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | G786-0602 |
| Compound Name: | 3-benzyl-6-(3,4-dimethylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1) |
| Molecular Weight: | 415.35 |
| Molecular Formula: | C19 H18 N4 S |
| Salt: | HBr |
| Smiles: | Cc1ccc(cc1C)C1CSc2nnc(Cc3ccccc3)n2N=1 |
| Stereo: | ACHIRAL |
| logP: | 4.5876 |
| logD: | 4.4677 |
| logSw: | -4.4868 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.934 |
| InChI Key: | PQJSCELHZTZOHN-UHFFFAOYSA-N |