N-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-N-(3-fluorophenyl)-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-N-(3-fluorophenyl)-3,5-dinitrobenzamide
N-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-N-(3-fluorophenyl)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 0547-0056 |
| Compound Name: | N-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-N-(3-fluorophenyl)-3,5-dinitrobenzamide |
| Molecular Weight: | 478.39 |
| Molecular Formula: | C23 H15 F N4 O7 |
| Smiles: | C(CN(C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)c1cccc(c1)F)N1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7781 |
| logD: | 3.7781 |
| logSw: | -4.1063 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.834 |
| InChI Key: | VWSDFVPSJDELCX-UHFFFAOYSA-N |