1-(4-fluorophenyl)-5-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-fluorophenyl)-5-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-fluorophenyl)-5-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 4299-0185 |
Compound Name: | 1-(4-fluorophenyl)-5-({3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 412.44 |
Molecular Formula: | C21 H17 F N2 O4 S |
Smiles: | COc1cc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)F)=S)=O)ccc1OCC=C |
Stereo: | ACHIRAL |
logP: | 3.2288 |
logD: | 2.8537 |
logSw: | -3.5747 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.363 |
InChI Key: | GQAVPYCPIQLLDS-UHFFFAOYSA-N |