5-(2,4-dimethylphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Chemical Structure Depiction of
5-(2,4-dimethylphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
5-(2,4-dimethylphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Compound characteristics
| Compound ID: | 8010-1781 |
| Compound Name: | 5-(2,4-dimethylphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one |
| Molecular Weight: | 311.29 |
| Molecular Formula: | C17 H13 N O5 |
| Smiles: | Cc1ccc(C2=C/C(=C/c3ccc([N+]([O-])=O)o3)C(=O)O2)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0733 |
| logD: | 4.0733 |
| logSw: | -4.2311 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.571 |
| InChI Key: | WUYCUDWZHVRNAI-UHFFFAOYSA-N |