3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine
Chemical Structure Depiction of
3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine
3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine
Compound characteristics
| Compound ID: | 8013-2095 |
| Compound Name: | 3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine |
| Molecular Weight: | 314.29 |
| Molecular Formula: | C11 H9 F3 N6 S |
| Smiles: | C(c1cccc(c1)C(F)(F)F)Sc1nnc2n(cnn12)N |
| Stereo: | ACHIRAL |
| logP: | 1.3704 |
| logD: | 1.3704 |
| logSw: | -1.4714 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.543 |
| InChI Key: | WXOCGCHUUAMVSY-UHFFFAOYSA-N |