6-{4-[(4-nitrophenyl)sulfanyl]phenyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-{4-[(4-nitrophenyl)sulfanyl]phenyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-{4-[(4-nitrophenyl)sulfanyl]phenyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
| Compound ID: | 3952-0050 |
| Compound Name: | 6-{4-[(4-nitrophenyl)sulfanyl]phenyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
| Molecular Weight: | 377.38 |
| Molecular Formula: | C19 H11 N3 O4 S |
| Smiles: | c1cc2C(N(C(c2nc1)=O)c1ccc(cc1)Sc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0772 |
| logD: | 3.0772 |
| logSw: | -3.6759 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.899 |
| InChI Key: | JEWYGGHZNFTGSR-UHFFFAOYSA-N |