ethyl ({1-[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({1-[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({1-[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D385-0150 |
| Compound Name: | ethyl ({1-[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C14 H22 N8 O2 S |
| Smiles: | CCN(CC)c1nc(NC)nc(n1)n1cnc(n1)SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.1824 |
| logD: | 3.1652 |
| logSw: | -3.3256 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.306 |
| InChI Key: | BIBBZLSKZMNWCK-UHFFFAOYSA-N |