6-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Chemical Structure Depiction of
6-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
6-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Compound characteristics
Compound ID: | G786-0616 |
Compound Name: | 6-(3,4-dimethylphenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1) |
Molecular Weight: | 431.35 |
Molecular Formula: | C19 H18 N4 O S |
Salt: | HBr |
Smiles: | Cc1ccc(cc1C)C1CSc2nnc(c3cccc(c3)OC)n2N=1 |
Stereo: | ACHIRAL |
logP: | 5.0151 |
logD: | 5.0086 |
logSw: | -4.7437 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 41.502 |
InChI Key: | AISZPVZUOQPCBA-UHFFFAOYSA-N |