1-(4-methoxyphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(4-methoxyphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
1-(4-methoxyphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C508-0068 |
| Compound Name: | 1-(4-methoxyphenyl)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 447.4 |
| Molecular Formula: | C23 H17 N3 O7 |
| Smiles: | Cc1ccc(cc1c1ccc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)OC)=O)=O)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7971 |
| logD: | 3.4843 |
| logSw: | -4.1321 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.886 |
| InChI Key: | ZDZJDRCPSRMRIC-UHFFFAOYSA-N |