1-(4-bromophenyl)-5-[(3-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(4-bromophenyl)-5-[(3-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(4-bromophenyl)-5-[(3-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3685-1951 |
| Compound Name: | 1-(4-bromophenyl)-5-[(3-methylthiophen-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 407.31 |
| Molecular Formula: | C16 H11 Br N2 O2 S2 |
| Smiles: | Cc1ccsc1\C=C1/C(NC(N(C1=O)c1ccc(cc1)[Br])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7654 |
| logD: | 3.6205 |
| logSw: | -4.0416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.247 |
| InChI Key: | ONUMTSJPHKBLGU-UHFFFAOYSA-N |