5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3620-0394 |
| Compound Name: | 5-[(3-bromo-4-propoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 369.23 |
| Molecular Formula: | C14 H13 Br N2 O3 S |
| Smiles: | CCCOc1ccc(C=C2C(NC(NC2=O)=S)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3765 |
| logD: | 2.9509 |
| logSw: | -3.5782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.13 |
| InChI Key: | IJTPRLAGVBGJGV-UHFFFAOYSA-N |