1-phenyl-2-sulfanylidene-5-[(2,3,4-trimethoxyphenyl)methylidene]-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-phenyl-2-sulfanylidene-5-[(2,3,4-trimethoxyphenyl)methylidene]-1,3-diazinane-4,6-dione
1-phenyl-2-sulfanylidene-5-[(2,3,4-trimethoxyphenyl)methylidene]-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3448-4393 |
Compound Name: | 1-phenyl-2-sulfanylidene-5-[(2,3,4-trimethoxyphenyl)methylidene]-1,3-diazinane-4,6-dione |
Molecular Weight: | 398.44 |
Molecular Formula: | C20 H18 N2 O5 S |
Smiles: | COc1ccc(\C=C2/C(NC(N(C2=O)c2ccccc2)=S)=O)c(c1OC)OC |
Stereo: | ACHIRAL |
logP: | 2.4879 |
logD: | 2.2623 |
logSw: | -2.9376 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.293 |
InChI Key: | HSIYTTYKFYMTCH-UHFFFAOYSA-N |