1-(3-ethoxyphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(3-ethoxyphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(3-ethoxyphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 4058-0110 |
| Compound Name: | 1-(3-ethoxyphenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 370.4 |
| Molecular Formula: | C19 H15 F N2 O3 S |
| Smiles: | CCOc1cccc(c1)N1C(C(=C/c2ccc(cc2)F)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3974 |
| logD: | 3.1718 |
| logSw: | -3.7618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.352 |
| InChI Key: | XIUPXIHVQITCMZ-UHFFFAOYSA-N |