1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3679-1168 |
Compound Name: | 1-(2-ethylphenyl)-5-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 420.46 |
Molecular Formula: | C23 H17 F N2 O3 S |
Smiles: | CCc1ccccc1N1C(C(=C\c2ccc(c3ccc(cc3)F)o2)\C(NC1=S)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.8352 |
logD: | 4.061 |
logSw: | -4.5512 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.497 |
InChI Key: | HRNVRYHTEGTSSJ-UHFFFAOYSA-N |