ethyl ({1-[4-(cyclopropylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({1-[4-(cyclopropylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({1-[4-(cyclopropylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D385-0380 |
| Compound Name: | ethyl ({1-[4-(cyclopropylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 364.43 |
| Molecular Formula: | C14 H20 N8 O2 S |
| Smiles: | CCOC(CSc1ncn(c2nc(NC3CC3)nc(n2)N(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6884 |
| logD: | 2.6853 |
| logSw: | -2.8237 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.009 |
| InChI Key: | VNOCXEKCPXEBGB-UHFFFAOYSA-N |