1-(2-fluorophenyl)-2-sulfanylidene-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2-fluorophenyl)-2-sulfanylidene-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione
1-(2-fluorophenyl)-2-sulfanylidene-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8010-7896 |
| Compound Name: | 1-(2-fluorophenyl)-2-sulfanylidene-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione |
| Molecular Weight: | 543.62 |
| Molecular Formula: | C33 H22 F N3 O2 S |
| Smiles: | C(=C1/C(NC(N(C1=O)c1ccccc1F)=S)=O)/c1cc(c2ccccc2)n(c2ccccc2)c1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5462 |
| logD: | 5.525 |
| logSw: | -6.1526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.108 |
| InChI Key: | HDOMZFORNGJUSX-UHFFFAOYSA-N |