5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3375-0226 |
| Compound Name: | 5-[(3-bromophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 311.15 |
| Molecular Formula: | C11 H7 Br N2 O2 S |
| Smiles: | C(=C1C(NC(NC1=O)=S)=O)c1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7608 |
| logD: | 2.3352 |
| logSw: | -3.284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.626 |
| InChI Key: | MFHMNRMQYBRGGP-UHFFFAOYSA-N |