5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-2-methyl-2-phenyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-2-methyl-2-phenyl-1,3-dioxane-4,6-dione
5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-2-methyl-2-phenyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 4181-0239 |
| Compound Name: | 5-{[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-2-methyl-2-phenyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 439.81 |
| Molecular Formula: | C22 H14 Cl N O7 |
| Smiles: | CC1(c2ccccc2)OC(C(=Cc2ccc(c3cc(ccc3[Cl])[N+]([O-])=O)o2)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.222 |
| logD: | 5.222 |
| logSw: | -5.6417 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.028 |
| InChI Key: | GEASQNAQFXMLAL-UHFFFAOYSA-N |