5-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
5-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C508-0072 |
| Compound Name: | 5-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 463.4 |
| Molecular Formula: | C23 H17 N3 O8 |
| Smiles: | COc1ccc(cc1)N1C(C(=C/c2ccc(c3ccc(cc3[N+]([O-])=O)OC)o2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4754 |
| logD: | 3.1627 |
| logSw: | -4.0111 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.129 |
| InChI Key: | XNOUEKKJXPPLFG-UHFFFAOYSA-N |