2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-(4-phenoxyphenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-(4-phenoxyphenyl)acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-(4-phenoxyphenyl)acetamide
Compound characteristics
| Compound ID: | E545-0637 |
| Compound Name: | 2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-(4-phenoxyphenyl)acetamide |
| Molecular Weight: | 561.55 |
| Molecular Formula: | C32 H23 N3 O7 |
| Smiles: | C(C(Nc1ccc(cc1)Oc1ccccc1)=O)N1C(N(Cc2ccc3c(c2)OCO3)C(c2c1c1ccccc1o2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4665 |
| logD: | 6.4665 |
| logSw: | -6.2641 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.584 |
| InChI Key: | DJWDMNKCKUOWMA-UHFFFAOYSA-N |