4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Chemical Structure Depiction of
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Compound characteristics
| Compound ID: | E596-0396 |
| Compound Name: | 4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C19 H27 N5 O3 S |
| Smiles: | CCN1C(c2c(ccs2)n2c(CCCC(NCCCOC(C)C)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9857 |
| logD: | 0.9857 |
| logSw: | -2.1792 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.507 |
| InChI Key: | QQNPSHKLTRXOBZ-UHFFFAOYSA-N |