1-(4-ethylphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(4-ethylphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(4-ethylphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C508-0113 |
| Compound Name: | 1-(4-ethylphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C24 H19 N3 O6 |
| Smiles: | CCc1ccc(cc1)N1C(C(=C/c2ccc(c3cc(ccc3C)[N+]([O-])=O)o2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7453 |
| logD: | 4.4326 |
| logSw: | -4.5194 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.342 |
| InChI Key: | ZYIHBJYMAVOXSA-UHFFFAOYSA-N |