2-[3-(4-ethoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[3-(4-ethoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-[3-(4-ethoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
Compound ID: | C242-0038 |
Compound Name: | 2-[3-(4-ethoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
Molecular Weight: | 556.66 |
Molecular Formula: | C26 H28 N4 O6 S2 |
Smiles: | CCOc1ccc(cc1)N1C(c2c(C)c(C)sc2N(CC(NCCc2ccc(cc2)S(N)(=O)=O)=O)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 2.087 |
logD: | 2.0862 |
logSw: | -2.9418 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 113.147 |
InChI Key: | LYVKBEVHZHVSKB-UHFFFAOYSA-N |