9-ethoxy-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
9-ethoxy-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
9-ethoxy-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0166 |
| Compound Name: | 9-ethoxy-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C21 H20 N2 O5 |
| Smiles: | CCOc1cccc(C2NC(C3Cc4cccc(c4OC=3N=2)OCC)=O)c1O |
| Stereo: | ACHIRAL |
| logP: | 3.5786 |
| logD: | 3.3653 |
| logSw: | -3.6169 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.301 |
| InChI Key: | AMMKKWTUNLDFPX-UHFFFAOYSA-N |