N-cyclohexyl-2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-cyclohexyl-2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-methylbenzene-1-sulfonamide
N-cyclohexyl-2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | E786-2158 |
| Compound Name: | N-cyclohexyl-2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 431.48 |
| Molecular Formula: | C21 H22 F N3 O4 S |
| Smiles: | CN(C1CCCCC1)S(c1cc(ccc1CN1C(c2cccnc2C1=O)=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.583 |
| logD: | 2.583 |
| logSw: | -3.1097 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.055 |
| InChI Key: | YCEYKFMKEKAKFT-UHFFFAOYSA-N |