5-[(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 4681-2891 |
| Compound Name: | 5-[(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C24 H21 N3 O5 S |
| Smiles: | CN1C(C(=Cc2cn(CCOc3ccc4c(c3)OCO4)c3ccccc23)C(N(C)C1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6155 |
| logD: | 2.6155 |
| logSw: | -3.0451 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.062 |
| InChI Key: | JJWFMEHFHDLDRU-UHFFFAOYSA-N |