5-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3699-1015 |
Compound Name: | 5-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 452.53 |
Molecular Formula: | C24 H24 N2 O5 S |
Smiles: | CCOc1cccc(c1)N1C(C(=C\c2cc(CC=C)c(c(c2)OCC)O)\C(NC1=S)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5517 |
logD: | 4.3261 |
logSw: | -4.3101 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.041 |
InChI Key: | CYVPOUPZVQKXKH-UHFFFAOYSA-N |