2-[(4-{[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Chemical Structure Depiction of
2-[(4-{[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile
2-[(4-{[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Compound characteristics
| Compound ID: | 3970-1841 |
| Compound Name: | 2-[(4-{[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C26 H19 N O3 |
| Smiles: | Cc1ccc(cc1)C1=C/C(=C\c2ccc(cc2)OCc2ccccc2C#N)C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 5.5867 |
| logD: | 5.5867 |
| logSw: | -5.5617 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.024 |
| InChI Key: | XXCNUTGGSUMHAM-UHFFFAOYSA-N |