N-[3-(dimethylamino)-4-methylphenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-(dimethylamino)-4-methylphenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
N-[3-(dimethylamino)-4-methylphenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2787 |
| Compound Name: | N-[3-(dimethylamino)-4-methylphenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | Cc1ccc(cc1N(C)C)NS(c1ccc(CN2C(c3cccnc3C2=O)=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7989 |
| logD: | 2.7347 |
| logSw: | -3.5692 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.554 |
| InChI Key: | MDMPSUGOHNOFRV-UHFFFAOYSA-N |