N-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-alanine
Chemical Structure Depiction of
N-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-alanine
N-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-alanine
Compound characteristics
| Compound ID: | Y042-8573 |
| Compound Name: | N-{[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetyl}-L-alanine |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C23 H23 N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(N[C@@H](C)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6731 |
| logD: | -0.9756 |
| logSw: | -3.1504 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.201 |
| InChI Key: | SECGYHKTCCQQKE-HNNXBMFYSA-N |