N-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalanine
Chemical Structure Depiction of
N-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalanine
N-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalanine
Compound characteristics
| Compound ID: | Y040-8377 |
| Compound Name: | N-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalanine |
| Molecular Weight: | 499.56 |
| Molecular Formula: | C30 H29 N O6 |
| Smiles: | CC(C(N[C@@H](Cc1ccccc1)C(O)=O)=O)Oc1ccc2C(C)=C(Cc3ccccc3)C(=O)Oc2c1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2205 |
| logD: | 0.6299 |
| logSw: | -4.4321 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.9 |
| InChI Key: | WSHNOFKKEWNFQJ-KUXBLMNESA-N |