5,7-dimethyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
Chemical Structure Depiction of
5,7-dimethyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
5,7-dimethyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine
Compound characteristics
| Compound ID: | 8601-0105 |
| Compound Name: | 5,7-dimethyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine |
| Molecular Weight: | 406.39 |
| Molecular Formula: | C16 H13 F3 N8 S |
| Smiles: | Cc1cc(C)n2c(nnc2n1)SCc1nnnn1c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.4665 |
| logD: | 2.4665 |
| logSw: | -2.5196 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.969 |
| InChI Key: | YHHANPDXFPUHPH-UHFFFAOYSA-N |