2-(methylsulfanyl)[1,2,4]triazolo[5',1':3,4][1,2,4]triazino[6,5-c]quinolin-6(7H)-one
Chemical Structure Depiction of
2-(methylsulfanyl)[1,2,4]triazolo[5',1':3,4][1,2,4]triazino[6,5-c]quinolin-6(7H)-one
2-(methylsulfanyl)[1,2,4]triazolo[5',1':3,4][1,2,4]triazino[6,5-c]quinolin-6(7H)-one
Compound characteristics
| Compound ID: | Y021-3442 |
| Compound Name: | 2-(methylsulfanyl)[1,2,4]triazolo[5',1':3,4][1,2,4]triazino[6,5-c]quinolin-6(7H)-one |
| Molecular Weight: | 284.3 |
| Molecular Formula: | C12 H8 N6 O S |
| Smiles: | CSc1nc2N=NC3=C(c4ccccc4NC3=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9719 |
| logD: | 2.9683 |
| logSw: | -3.7253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.263 |
| InChI Key: | RYSSRYWIRDSWIN-UHFFFAOYSA-N |