5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8006-9199 |
| Compound Name: | 5-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 361.7 |
| Molecular Formula: | C15 H8 Cl N3 O6 |
| Smiles: | C(=C1C(NC(NC1=O)=O)=O)c1ccc(c2ccc(cc2[Cl])[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4544 |
| logD: | 2.0965 |
| logSw: | -3.7742 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.594 |
| InChI Key: | LYYMMLNTEGASMV-UHFFFAOYSA-N |