N-(3-cyanophenyl)-2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Chemical Structure Depiction of
N-(3-cyanophenyl)-2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
N-(3-cyanophenyl)-2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Compound characteristics
| Compound ID: | Y040-1532 |
| Compound Name: | N-(3-cyanophenyl)-2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C25 H18 N2 O5 |
| Smiles: | COc1ccc(cc1)C1=CC(=O)Oc2cc(ccc12)OCC(Nc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8441 |
| logD: | 3.8439 |
| logSw: | -4.2057 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.351 |
| InChI Key: | NIHGXHCGSPUCDW-UHFFFAOYSA-N |