N-cyclooctyl-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-cyclooctyl-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
N-cyclooctyl-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2438 |
| Compound Name: | N-cyclooctyl-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | C1CCCC(CCC1)NS(c1ccc(CCN2C(c3cccnc3C2=O)=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3707 |
| logD: | 3.3706 |
| logSw: | -3.9367 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.407 |
| InChI Key: | KGACDGMPZAORMX-UHFFFAOYSA-N |