methyl {[7-(2-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[7-(2-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetate
methyl {[7-(2-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y020-4333 |
| Compound Name: | methyl {[7-(2-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 334.78 |
| Molecular Formula: | C14 H11 Cl N4 O2 S |
| Smiles: | COC(CSc1nc2nccc(c3ccccc3[Cl])n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4112 |
| logD: | 2.4112 |
| logSw: | -3.1252 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.514 |
| InChI Key: | ABLYKNZQECKUIA-UHFFFAOYSA-N |