ethyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D396-0011 |
| Compound Name: | ethyl {[1-(2-amino-6-methylpyrimidin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 294.33 |
| Molecular Formula: | C11 H14 N6 O2 S |
| Smiles: | CCOC(CSc1ncn(c2cc(C)nc(N)n2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3341 |
| logD: | 1.3293 |
| logSw: | -1.9253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.366 |
| InChI Key: | YWYRZFWCYVXPRY-UHFFFAOYSA-N |