1-(3-bromophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(3-bromophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(3-bromophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3970-1182 |
| Compound Name: | 1-(3-bromophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 447.31 |
| Molecular Formula: | C19 H15 Br N2 O4 S |
| Smiles: | COc1ccc(\C=C2/C(NC(N(C2=O)c2cccc(c2)[Br])=S)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6203 |
| logD: | 2.7798 |
| logSw: | -4.0636 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.403 |
| InChI Key: | JCEPBYXKBLOXQO-UHFFFAOYSA-N |