5-(3,4-dimethoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
5-(3,4-dimethoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one
Compound characteristics
| Compound ID: | 5639-0174 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-3-[(5-nitrofuran-2-yl)methylidene]furan-2(3H)-one |
| Molecular Weight: | 343.29 |
| Molecular Formula: | C17 H13 N O7 |
| Smiles: | COc1ccc(cc1OC)C1=C/C(=C/c2ccc([N+]([O-])=O)o2)C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 2.8711 |
| logD: | 2.8711 |
| logSw: | -3.4581 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.831 |
| InChI Key: | LVRDRMWLTHHRPC-UHFFFAOYSA-N |