methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalaninate
Chemical Structure Depiction of
methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalaninate
methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalaninate
Compound characteristics
| Compound ID: | Y041-1489 |
| Compound Name: | methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}phenylalaninate |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C23 H23 N O6 |
| Smiles: | CC(C(N[C@@H](Cc1ccccc1)C(=O)OC)=O)Oc1ccc2C(C)=CC(=O)Oc2c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5915 |
| logD: | 2.5914 |
| logSw: | -3.2247 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.652 |
| InChI Key: | NOEUTJPGRFROPL-FUBQLUNQSA-N |