5-[(3-bromo-5-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-bromo-5-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-bromo-5-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3351-0072 |
| Compound Name: | 5-[(3-bromo-5-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 531.42 |
| Molecular Formula: | C24 H23 Br N2 O5 S |
| Smiles: | CCOc1cc(C=C2C(NC(NC2=O)=S)=O)cc(c1OCCOc1ccccc1CC=C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.1298 |
| logD: | 4.7043 |
| logSw: | -5.0063 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.66 |
| InChI Key: | YBVBXLHZZGBDAD-UHFFFAOYSA-N |