N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | E545-0712 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 513.51 |
| Molecular Formula: | C28 H23 N3 O7 |
| Smiles: | COc1ccc(CN2C(c3c(c4ccccc4o3)N(CC(Nc3ccc4c(c3)OCCO4)=O)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8601 |
| logD: | 3.8601 |
| logSw: | -4.1582 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.088 |
| InChI Key: | GOTCAOORTZXKPE-UHFFFAOYSA-N |