6-{[4-methoxy-3-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-{[4-methoxy-3-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-{[4-methoxy-3-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
| Compound ID: | G115-0032 |
| Compound Name: | 6-{[4-methoxy-3-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
| Molecular Weight: | 478.48 |
| Molecular Formula: | C23 H18 N4 O6 S |
| Smiles: | COc1ccc(CN2C(c3cccnc3C2=O)=O)cc1S(N1CC(Nc2ccccc12)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8747 |
| logD: | 0.8746 |
| logSw: | -2.6769 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.017 |
| InChI Key: | WILGTRFXJQYQCH-UHFFFAOYSA-N |