4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2553 |
| Compound Name: | 4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(5-methylfuran-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C21 H19 N3 O5 S |
| Smiles: | [H]N(Cc1ccc(C)o1)S(c1ccc(CCN2C(c3cccnc3C2=O)=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8173 |
| logD: | 1.8172 |
| logSw: | -2.7134 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.4 |
| InChI Key: | LLYHOSXBEXMCJK-UHFFFAOYSA-N |