ethyl ({1-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({1-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({1-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D385-0146 |
| Compound Name: | ethyl ({1-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 325.35 |
| Molecular Formula: | C11 H15 N7 O3 S |
| Smiles: | CCOC(CSc1ncn(c2nc(NC)nc(n2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.836 |
| logD: | 1.8359 |
| logSw: | -2.3113 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.987 |
| InChI Key: | TZYGMTIQSVWVSZ-UHFFFAOYSA-N |