1-(4-chlorophenyl)-5-[3-(furan-2-yl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-[3-(furan-2-yl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-chlorophenyl)-5-[3-(furan-2-yl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3448-4425 |
Compound Name: | 1-(4-chlorophenyl)-5-[3-(furan-2-yl)prop-2-en-1-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 358.8 |
Molecular Formula: | C17 H11 Cl N2 O3 S |
Smiles: | C(=C\c1ccco1)\C=C1/C(NC(N(C1=O)c1ccc(cc1)[Cl])=S)=O |
Stereo: | ACHIRAL |
logP: | 2.9541 |
logD: | 1.5075 |
logSw: | -3.7105 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.977 |
InChI Key: | KZWHYDFZLWFHNB-UHFFFAOYSA-N |