2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(4-ethoxyphenyl)-5-fluorobenzene-1-sulfonamide
Chemical Structure Depiction of
2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(4-ethoxyphenyl)-5-fluorobenzene-1-sulfonamide
2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(4-ethoxyphenyl)-5-fluorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | E786-2137 |
| Compound Name: | 2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(4-ethoxyphenyl)-5-fluorobenzene-1-sulfonamide |
| Molecular Weight: | 455.46 |
| Molecular Formula: | C22 H18 F N3 O5 S |
| Smiles: | CCOc1ccc(cc1)NS(c1cc(ccc1CN1C(c2cccnc2C1=O)=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4648 |
| logD: | 2.3142 |
| logSw: | -3.0749 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.174 |
| InChI Key: | PFAMXPZBIYQPDL-UHFFFAOYSA-N |