2-{4-[2-(benzylsulfanyl)-1-methyl-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl]-2-ethoxyphenoxy}acetamide
Chemical Structure Depiction of
2-{4-[2-(benzylsulfanyl)-1-methyl-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl]-2-ethoxyphenoxy}acetamide
2-{4-[2-(benzylsulfanyl)-1-methyl-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl]-2-ethoxyphenoxy}acetamide
Compound characteristics
Compound ID: | D271-0582 |
Compound Name: | 2-{4-[2-(benzylsulfanyl)-1-methyl-4,7-dioxo-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl]-2-ethoxyphenoxy}acetamide |
Molecular Weight: | 494.57 |
Molecular Formula: | C25 H26 N4 O5 S |
Smiles: | CCOc1cc(ccc1OCC(N)=O)C1CC(NC2=C1C(N=C(N2C)SCc1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.9121 |
logD: | 0.812 |
logSw: | -2.2753 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 98.266 |
InChI Key: | KKFVEPXTNHNGFB-KRWDZBQOSA-N |