5-({3-bromo-4-[(3-nitrophenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-({3-bromo-4-[(3-nitrophenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
5-({3-bromo-4-[(3-nitrophenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 4489-8151 |
| Compound Name: | 5-({3-bromo-4-[(3-nitrophenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 446.21 |
| Molecular Formula: | C18 H12 Br N3 O6 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)Oc1ccc(C=C2C(NC(NC2=O)=O)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7118 |
| logD: | 2.3646 |
| logSw: | -3.1705 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.339 |
| InChI Key: | KIFBFMQCRFFKLE-UHFFFAOYSA-N |