1-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propan-2-one
Chemical Structure Depiction of
1-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propan-2-one
1-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propan-2-one
Compound characteristics
| Compound ID: | D278-1054 |
| Compound Name: | 1-[([1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]propan-2-one |
| Molecular Weight: | 257.31 |
| Molecular Formula: | C13 H11 N3 O S |
| Smiles: | CC(CSc1nnc2ccc3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1357 |
| logD: | 2.1357 |
| logSw: | -2.4765 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.688 |
| InChI Key: | TUWSDNILHDMNFQ-UHFFFAOYSA-N |