4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(4-fluorophenyl)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-[(4-fluorophenyl)methyl]benzene-1-sulfonamide
4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(4-fluorophenyl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2522 |
| Compound Name: | 4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]-N-[(4-fluorophenyl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 439.46 |
| Molecular Formula: | C22 H18 F N3 O4 S |
| Smiles: | C(CN1C(c2cccnc2C1=O)=O)c1ccc(cc1)S(NCc1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0172 |
| logD: | 2.017 |
| logSw: | -2.8942 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.137 |
| InChI Key: | NAWFCHVOEXGZNV-UHFFFAOYSA-N |