N-(3-cyanophenyl)-2-[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-2-[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
N-(3-cyanophenyl)-2-[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide
Compound characteristics
| Compound ID: | Y041-3034 |
| Compound Name: | N-(3-cyanophenyl)-2-[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamide |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C25 H26 N2 O4 |
| Smiles: | CCCCCCC1=C(C)c2ccc(cc2OC1=O)OCC(Nc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.913 |
| logD: | 5.9128 |
| logSw: | -5.2958 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.593 |
| InChI Key: | JWMLVJWINCLISU-UHFFFAOYSA-N |