1-(2H-1,3-benzodioxol-5-yl)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione
1-(2H-1,3-benzodioxol-5-yl)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 4799-1907 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 465.46 |
| Molecular Formula: | C27 H19 N3 O5 |
| Smiles: | C(c1ccccc1)n1cc(\C=C2/C(NC(N(C2=O)c2ccc3c(c2)OCO3)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.8555 |
| logD: | 3.4837 |
| logSw: | -4.1473 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.238 |
| InChI Key: | CFQBOPNVOBWKLF-UHFFFAOYSA-N |