5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3679-0050 |
| Compound Name: | 5-[(1-ethyl-1H-indol-3-yl)methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H16 F N3 O2 S |
| Smiles: | CCn1cc(\C=C2/C(NC(N(C2=O)c2ccccc2F)=S)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.1538 |
| logD: | 1.6719 |
| logSw: | -3.3107 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.656 |
| InChI Key: | IGNSBUAPDSWGHL-UHFFFAOYSA-N |