6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-(heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine
Chemical Structure Depiction of
6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-(heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine
6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-(heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine
Compound characteristics
Compound ID: | 8010-8153 |
Compound Name: | 6-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-3-(heptafluoropropyl)[1,2,4]triazolo[4,3-b]pyridazine |
Molecular Weight: | 426.32 |
Molecular Formula: | C14 H9 F7 N6 S |
Smiles: | Cc1cc(C)nc(n1)Sc1ccc2nnc(C(C(C(F)(F)F)(F)F)(F)F)n2n1 |
Stereo: | ACHIRAL |
logP: | 3.8701 |
logD: | 3.8701 |
logSw: | -3.9154 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.664 |
InChI Key: | FVSATDQRASQLEK-UHFFFAOYSA-N |