5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(thiophen-2-yl)methyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(thiophen-2-yl)methyl]thiophene-2-sulfonamide
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(thiophen-2-yl)methyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | E786-1999 |
| Compound Name: | 5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(thiophen-2-yl)methyl]thiophene-2-sulfonamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C17 H13 N3 O4 S3 |
| Smiles: | C(c1cccs1)NS(c1ccc(CN2C(c3cccnc3C2=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6011 |
| logD: | 1.5992 |
| logSw: | -2.7471 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.195 |
| InChI Key: | XNBBQERXEDLLHG-UHFFFAOYSA-N |