methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methioninate
Chemical Structure Depiction of
methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methioninate
methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methioninate
Compound characteristics
| Compound ID: | Y041-1491 |
| Compound Name: | methyl N-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}methioninate |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C19 H23 N O6 S |
| Smiles: | CC(C(N[C@@H](CCSC)C(=O)OC)=O)Oc1ccc2C(C)=CC(=O)Oc2c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7166 |
| logD: | 1.7166 |
| logSw: | -2.5986 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.924 |
| InChI Key: | HJWZHEQPDUXAHJ-CVRLYYSRSA-N |