5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 4490-0925 |
| Compound Name: | 5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 416.88 |
| Molecular Formula: | C20 H17 Cl N2 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(C(=C\c2cc(c(c(c2)[Cl])O)OC)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0638 |
| logD: | 3.6888 |
| logSw: | -4.2304 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.338 |
| InChI Key: | NEXKZNGXKHYYDJ-UHFFFAOYSA-N |