5-bromo-2-(2-fluoro-5-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-bromo-2-(2-fluoro-5-nitrophenyl)-1H-isoindole-1,3(2H)-dione
5-bromo-2-(2-fluoro-5-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | R052-1055 |
| Compound Name: | 5-bromo-2-(2-fluoro-5-nitrophenyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 365.11 |
| Molecular Formula: | C14 H6 Br F N2 O4 |
| Smiles: | c1cc(c(cc1[N+]([O-])=O)N1C(c2ccc(cc2C1=O)[Br])=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.8464 |
| logD: | 3.8464 |
| logSw: | -4.1542 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.96 |
| InChI Key: | GYHRMKMDCFTHHT-UHFFFAOYSA-N |