6-{[4-fluoro-2-(4-methylpiperazine-1-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Chemical Structure Depiction of
6-{[4-fluoro-2-(4-methylpiperazine-1-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
6-{[4-fluoro-2-(4-methylpiperazine-1-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Compound characteristics
| Compound ID: | E786-2169 |
| Compound Name: | 6-{[4-fluoro-2-(4-methylpiperazine-1-sulfonyl)phenyl]methyl}-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C19 H19 F N4 O4 S |
| Smiles: | CN1CCN(CC1)S(c1cc(ccc1CN1C(c2cccnc2C1=O)=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3156 |
| logD: | 0.2529 |
| logSw: | -2.4327 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.588 |
| InChI Key: | NOOBAYPQEFEFSO-UHFFFAOYSA-N |