5-({3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-({3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
5-({3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2958-7481 |
| Compound Name: | 5-({3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 427.37 |
| Molecular Formula: | C20 H17 N3 O8 |
| Smiles: | COc1cc(C=C2C(NC(NC2=O)=O)=O)ccc1OCCOc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9349 |
| logD: | 1.5877 |
| logSw: | -2.7758 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.306 |
| InChI Key: | KWPQHPHTAMCLNB-UHFFFAOYSA-N |