5-(4-methoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Chemical Structure Depiction of
5-(4-methoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
5-(4-methoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Compound characteristics
| Compound ID: | 5639-0115 |
| Compound Name: | 5-(4-methoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one |
| Molecular Weight: | 313.26 |
| Molecular Formula: | C16 H11 N O6 |
| Smiles: | COc1ccc(cc1)C1=C/C(=C/c2ccc([N+]([O-])=O)o2)C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.2923 |
| logD: | 3.2923 |
| logSw: | -3.7141 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.114 |
| InChI Key: | QBSFQTSBKWMIKN-UHFFFAOYSA-N |