1-{7-[2-(dimethylamino)ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethan-1-one
Chemical Structure Depiction of
1-{7-[2-(dimethylamino)ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethan-1-one
1-{7-[2-(dimethylamino)ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethan-1-one
Compound characteristics
| Compound ID: | Y020-9775 |
| Compound Name: | 1-{7-[2-(dimethylamino)ethenyl]-2-(ethylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}ethan-1-one |
| Molecular Weight: | 291.37 |
| Molecular Formula: | C13 H17 N5 O S |
| Smiles: | CCSc1nc2ncc(C(C)=O)c(/C=C/N(C)C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1682 |
| logD: | 1.1633 |
| logSw: | -1.9972 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.878 |
| InChI Key: | XUTQIUHRSJJMGG-UHFFFAOYSA-N |