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-(2,6-dimethylphenyl)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-(2,6-dimethylphenyl)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-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | E545-0632 |
| 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-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 497.51 |
| Molecular Formula: | C28 H23 N3 O6 |
| Smiles: | Cc1cccc(C)c1NC(CN1C(N(Cc2ccc3c(c2)OCO3)C(c2c1c1ccccc1o2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9611 |
| logD: | 4.9611 |
| logSw: | -4.8342 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.441 |
| InChI Key: | OAWCRECEZXIYTQ-UHFFFAOYSA-N |