2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E786-2221 |
| Compound Name: | 2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 429.43 |
| Molecular Formula: | C20 H16 F N3 O5 S |
| Smiles: | [H]N(Cc1ccc(C)o1)S(c1cc(ccc1CN1C(c2cccnc2C1=O)=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8189 |
| logD: | 1.8186 |
| logSw: | -2.8351 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.422 |
| InChI Key: | IHQBIFOSMXKOPL-UHFFFAOYSA-N |