N-[(7-hydroxy-3,4-dimethyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-phenylalanine
Chemical Structure Depiction of
N-[(7-hydroxy-3,4-dimethyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-phenylalanine
N-[(7-hydroxy-3,4-dimethyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-phenylalanine
Compound characteristics
| Compound ID: | Y042-8710 |
| Compound Name: | N-[(7-hydroxy-3,4-dimethyl-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-phenylalanine |
| Molecular Weight: | 367.4 |
| Molecular Formula: | C21 H21 N O5 |
| Smiles: | CC1=C(C)c2ccc(c(CN[C@@H](Cc3ccccc3)C(O)=O)c2OC1=O)O |
| Stereo: | ABSOLUTE |
| logP: | 1.9687 |
| logD: | -0.73 |
| logSw: | -2.8183 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.988 |
| InChI Key: | LNQHLDWJEICHGF-KRWDZBQOSA-N |