5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(furan-2-yl)methyl]-2-methoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(furan-2-yl)methyl]-2-methoxy-N-methylbenzene-1-sulfonamide
5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(furan-2-yl)methyl]-2-methoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | E912-0405 |
| Compound Name: | 5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-[(furan-2-yl)methyl]-2-methoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C21 H19 N3 O6 S |
| Smiles: | CN(Cc1ccco1)S(c1cc(CN2C(c3cccnc3C2=O)=O)ccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3326 |
| logD: | 1.3326 |
| logSw: | -2.3563 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.344 |
| InChI Key: | MPCCETUPHFFFHO-UHFFFAOYSA-N |