4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(3-ethylphenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(3-ethylphenyl)benzene-1-sulfonamide
4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(3-ethylphenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2729 |
| Compound Name: | 4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-(3-ethylphenyl)benzene-1-sulfonamide |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C22 H19 N3 O4 S |
| Smiles: | CCc1cccc(c1)NS(c1ccc(CN2C(c3cccnc3C2=O)=O)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7759 |
| logD: | 2.7654 |
| logSw: | -3.4418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.05 |
| InChI Key: | UMLFKKWANUWVSI-UHFFFAOYSA-N |