1-(4-bromophenyl)-5-[(2-ethoxynaphthalen-1-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-bromophenyl)-5-[(2-ethoxynaphthalen-1-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-bromophenyl)-5-[(2-ethoxynaphthalen-1-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3288-0078 |
Compound Name: | 1-(4-bromophenyl)-5-[(2-ethoxynaphthalen-1-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 481.37 |
Molecular Formula: | C23 H17 Br N2 O3 S |
Smiles: | CCOc1ccc2ccccc2c1/C=C1/C(NC(N(C1=O)c1ccc(cc1)[Br])=S)=O |
Stereo: | ACHIRAL |
logP: | 4.9686 |
logD: | 4.5302 |
logSw: | -5.5036 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.167 |
InChI Key: | NMPBZOVYNFAYDU-UHFFFAOYSA-N |