5-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
5-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8009-7906 |
| Compound Name: | 5-{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 355.3 |
| Molecular Formula: | C17 H13 N3 O6 |
| Smiles: | [H]N1C(C(=Cc2ccc(c3cc(C)c(C)cc3[N+]([O-])=O)o2)C(N([H])C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6836 |
| logD: | 2.3257 |
| logSw: | -3.3495 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.294 |
| InChI Key: | QYTPDYMLXCOCAT-UHFFFAOYSA-N |