5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E912-0273 |
| Compound Name: | 5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C23 H21 N3 O5 S |
| Smiles: | Cc1ccc(CNS(c2cc(CN3C(c4cccnc4C3=O)=O)ccc2OC)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1872 |
| logD: | 2.187 |
| logSw: | -3.049 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.789 |
| InChI Key: | OJZWZQMCHQOEEQ-UHFFFAOYSA-N |