4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-fluoro-3-nitrophenyl)benzamide
Chemical Structure Depiction of
4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-fluoro-3-nitrophenyl)benzamide
4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-fluoro-3-nitrophenyl)benzamide
Compound characteristics
| Compound ID: | F217-0397 |
| Compound Name: | 4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-fluoro-3-nitrophenyl)benzamide |
| Molecular Weight: | 436.44 |
| Molecular Formula: | C24 H21 F N2 O5 |
| Smiles: | CC1(C)Cc2cccc(c2O1)OCc1ccc(cc1)C(Nc1ccc(c(c1)[N+]([O-])=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0986 |
| logD: | 4.3129 |
| logSw: | -5.1374 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.107 |
| InChI Key: | PLIJPABOKGDHLA-UHFFFAOYSA-N |