1-(4-fluorophenyl)-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-fluorophenyl)-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-fluorophenyl)-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8012-5952 |
| Compound Name: | 1-(4-fluorophenyl)-5-[(5-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 346.4 |
| Molecular Formula: | C16 H11 F N2 O2 S2 |
| Smiles: | Cc1ccc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)F)=S)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0998 |
| logD: | 2.6116 |
| logSw: | -3.4003 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.247 |
| InChI Key: | KXFOCXRVKPGLHA-UHFFFAOYSA-N |