2-{[9-ethoxy-2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[9-ethoxy-2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
2-{[9-ethoxy-2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | C683-0420 |
Compound Name: | 2-{[9-ethoxy-2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
Molecular Weight: | 437.52 |
Molecular Formula: | C23 H23 N3 O4 S |
Smiles: | CCOc1ccc(cc1)c1nc2c(Cc3cccc(c3O2)OCC)c(n1)SCC(N)=O |
Stereo: | ACHIRAL |
logP: | 5.2204 |
logD: | 5.2174 |
logSw: | -5.0921 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.808 |
InChI Key: | MNANVDXCRJNZHI-UHFFFAOYSA-N |