N-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methionine
Chemical Structure Depiction of
N-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methionine
N-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methionine
Compound characteristics
| Compound ID: | Y042-8432 |
| Compound Name: | N-{2-[(4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methionine |
| Molecular Weight: | 407.48 |
| Molecular Formula: | C20 H25 N O6 S |
| Smiles: | CCC1=CC(=O)Oc2c1ccc(c2C)OC(C)C(N[C@@H](CCSC)C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0368 |
| logD: | -1.5811 |
| logSw: | -2.9568 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.929 |
| InChI Key: | ZHUNDGFEUMJLEA-CVRLYYSRSA-N |