2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]-N-(4-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]-N-(4-cyanophenyl)acetamide
2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]-N-(4-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | Y040-1455 |
| Compound Name: | 2-[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]-N-(4-cyanophenyl)acetamide |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C27 H22 N2 O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(C)cc(c12)OCC(Nc1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2985 |
| logD: | 5.2982 |
| logSw: | -5.3946 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.408 |
| InChI Key: | GQNMKHOXRPKBOP-UHFFFAOYSA-N |