N-(4-acetylphenyl)-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
N-(4-acetylphenyl)-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | E786-1869 |
| Compound Name: | N-(4-acetylphenyl)-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C20 H15 N3 O5 S2 |
| Smiles: | CC(c1ccc(cc1)NS(c1ccc(CN2C(c3cccnc3C2=O)=O)s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6111 |
| logD: | 1.3663 |
| logSw: | -2.693 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.895 |
| InChI Key: | KOBVCOGTUAVYSV-UHFFFAOYSA-N |