1-(2,5-dimethoxyphenyl)-5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(2,5-dimethoxyphenyl)-5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
1-(2,5-dimethoxyphenyl)-5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 8013-6820 |
Compound Name: | 1-(2,5-dimethoxyphenyl)-5-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 524.27 |
Molecular Formula: | C20 H17 I N2 O7 |
Smiles: | COc1ccc(c(c1)N1C(C(=C\c2cc(c(c(c2)I)O)OC)\C(NC1=O)=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 3.0144 |
logD: | 2.9343 |
logSw: | -3.4873 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.374 |
InChI Key: | BCSULTZHAMMARE-UHFFFAOYSA-N |