2-(4-{2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}phenoxy)acetamide
Chemical Structure Depiction of
2-(4-{2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}phenoxy)acetamide
2-(4-{2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}phenoxy)acetamide
Compound characteristics
| Compound ID: | 6959-0644 |
| Compound Name: | 2-(4-{2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-3,9-dioxo-1,2,3,9-tetrahydro[1]benzopyrano[2,3-c]pyrrol-1-yl}phenoxy)acetamide |
| Molecular Weight: | 498.49 |
| Molecular Formula: | C28 H22 N2 O7 |
| Smiles: | Cc1ccc2c(c1)C(C1C(c3ccc(cc3)OCC(N)=O)N(Cc3ccc4c(c3)OCO4)C(C=1O2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0096 |
| logD: | 3.0096 |
| logSw: | -3.3093 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.735 |
| InChI Key: | WREIBPDVGUQGDG-RUZDIDTESA-N |