4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-(4-fluoro-2-methylphenyl)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-(4-fluoro-2-methylphenyl)benzene-1-sulfonamide
4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-(4-fluoro-2-methylphenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2555 |
| Compound Name: | 4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-(4-fluoro-2-methylphenyl)benzene-1-sulfonamide |
| Molecular Weight: | 439.46 |
| Molecular Formula: | C22 H18 F N3 O4 S |
| Smiles: | Cc1cc(ccc1NS(c1ccc(CCN2C(c3cccnc3C2=O)=O)cc1)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 2.2912 |
| logD: | 1.5726 |
| logSw: | -3.0085 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.33 |
| InChI Key: | FGFVZQLRJHAUDE-UHFFFAOYSA-N |