4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[4-(decyloxy)phenyl]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[4-(decyloxy)phenyl]-1,3-oxazol-5(4H)-one
4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[4-(decyloxy)phenyl]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2165-1022 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methylidene]-2-[4-(decyloxy)phenyl]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C27 H31 N O5 |
| Smiles: | CCCCCCCCCCOc1ccc(cc1)C1=NC(=C/c2ccc3c(c2)OCO3)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 7.6567 |
| logD: | 7.6567 |
| logSw: | -5.7487 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.909 |
| InChI Key: | AMRQYSSERUQRDI-UHFFFAOYSA-N |