6-{[5-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-{[5-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-{[5-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
| Compound ID: | K906-4910 |
| Compound Name: | 6-{[5-(3-oxo-3,4-dihydroquinoxaline-1(2H)-sulfonyl)thiophen-2-yl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C20 H14 N4 O5 S2 |
| Smiles: | C(c1ccc(s1)S(N1CC(Nc2ccccc12)=O)(=O)=O)N1C(c2cccnc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9217 |
| logD: | 0.9216 |
| logSw: | -2.6085 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.405 |
| InChI Key: | YQSFSPTVKKHQJH-UHFFFAOYSA-N |