2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-propylacetamide
Chemical Structure Depiction of
2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-propylacetamide
2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-propylacetamide
Compound characteristics
| Compound ID: | L397-0276 |
| Compound Name: | 2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-propylacetamide |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C17 H23 N5 O3 S |
| Smiles: | CCCNC(CN1C(N2C(=N1)N(CCC(C)C)C(c1c2ccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2487 |
| logD: | 2.2487 |
| logSw: | -2.7384 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.788 |
| InChI Key: | FEDUTVBGHYSCGO-UHFFFAOYSA-N |