N-(3-chloro-4-fluorophenyl)-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
N-(3-chloro-4-fluorophenyl)-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2539 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-[2-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 459.88 |
| Molecular Formula: | C21 H15 Cl F N3 O4 S |
| Smiles: | C(CN1C(c2cccnc2C1=O)=O)c1ccc(cc1)S(Nc1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7572 |
| logD: | 0.4881 |
| logSw: | -3.7373 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.028 |
| InChI Key: | FSHVSYDEDVLMML-UHFFFAOYSA-N |