5-{[5-(4-ethoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(4-ethoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
5-{[5-(4-ethoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C508-0015 |
| Compound Name: | 5-{[5-(4-ethoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 475.46 |
| Molecular Formula: | C25 H21 N3 O7 |
| Smiles: | CCOc1ccc(c(c1)[N+]([O-])=O)c1ccc(/C=C2/C(NC(N(C(C)c3ccccc3)C2=O)=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7467 |
| logD: | 4.7369 |
| logSw: | -4.505 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.117 |
| InChI Key: | UAEKVZIWBMOOLX-HNNXBMFYSA-N |