5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C508-0014 |
| Compound Name: | 5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(1-phenylethyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C24 H19 N3 O6 |
| Smiles: | CC(c1ccccc1)N1C(C(=C/c2ccc(c3cc(ccc3C)[N+]([O-])=O)o2)\C(NC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6809 |
| logD: | 4.6711 |
| logSw: | -4.5261 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.294 |
| InChI Key: | SDSPCQIJGZJSFK-HNNXBMFYSA-N |