5-[(3-bromo-4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-ethoxyphenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(3-bromo-4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-ethoxyphenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
5-[(3-bromo-4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-ethoxyphenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 2958-7375 |
| Compound Name: | 5-[(3-bromo-4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-ethoxyphenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 621.53 |
| Molecular Formula: | C32 H33 Br N2 O6 |
| Smiles: | CCC(C)c1ccc(cc1)OCCOc1c(cc(/C=C2/C(NC(N(C2=O)c2ccc(C)cc2)=O)=O)cc1[Br])OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9412 |
| logD: | 6.6381 |
| logSw: | -5.5798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.338 |
| InChI Key: | ITYUPXUEJRXEBE-NRFANRHFSA-N |