N-{[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
Chemical Structure Depiction of
N-{[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
N-{[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
Compound characteristics
| Compound ID: | Y040-8342 |
| Compound Name: | N-{[(3-hexyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C27 H31 N O6 |
| Smiles: | CCCCCCC1=C(C)c2ccc(cc2OC1=O)OCC(N[C@@H](Cc1ccccc1)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.4111 |
| logD: | 0.8205 |
| logSw: | -4.3523 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.898 |
| InChI Key: | TZBDNQFYNGKIER-QHCPKHFHSA-N |