5-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
5-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3728-0616 |
| Compound Name: | 5-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 465.85 |
| Molecular Formula: | C23 H16 Cl N3 O6 |
| Smiles: | Cc1ccc(cc1C)N1C(C(=C\c2ccc(c3ccc(cc3[N+]([O-])=O)[Cl])o2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8943 |
| logD: | 4.8147 |
| logSw: | -4.9237 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.041 |
| InChI Key: | RCAWZUSJBOESMI-UHFFFAOYSA-N |