N-(2,3-dimethylcyclohexyl)-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
N-(2,3-dimethylcyclohexyl)-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2738 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | CC1CCCC(C1C)NS(c1ccc(CN2C(c3cccnc3C2=O)=O)cc1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3629 |
| logD: | 2.3629 |
| logSw: | -2.9617 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.487 |
| InChI Key: | VMSBOKRHIFXODJ-UHFFFAOYSA-N |