N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
Chemical Structure Depiction of
N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine
Compound characteristics
| Compound ID: | Y040-8302 |
| Compound Name: | N-{[(4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-phenylalanine |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C25 H27 N O6 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OCC(N[C@@H](Cc1ccccc1)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.2612 |
| logD: | -0.3294 |
| logSw: | -3.5225 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.154 |
| InChI Key: | JCUJHHAQRQYQRF-FQEVSTJZSA-N |