N-(2-ethoxyphenyl)-2-{4-[(furan-2-yl)methyl]-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}acetamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{4-[(furan-2-yl)methyl]-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}acetamide
N-(2-ethoxyphenyl)-2-{4-[(furan-2-yl)methyl]-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}acetamide
Compound characteristics
Compound ID: | L397-0692 |
Compound Name: | N-(2-ethoxyphenyl)-2-{4-[(furan-2-yl)methyl]-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl}acetamide |
Molecular Weight: | 465.49 |
Molecular Formula: | C22 H19 N5 O5 S |
Smiles: | CCOc1ccccc1NC(CN1C(N2C(=N1)N(Cc1ccco1)C(c1c2ccs1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0554 |
logD: | 3.0553 |
logSw: | -3.386 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.364 |
InChI Key: | HPOFLAMSXYLOPN-UHFFFAOYSA-N |