N-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}valine
Chemical Structure Depiction of
N-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}valine
N-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}valine
Compound characteristics
| Compound ID: | Y041-6543 |
| Compound Name: | N-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanoyl}valine |
| Molecular Weight: | 361.39 |
| Molecular Formula: | C19 H23 N O6 |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(C(C)Oc1ccc2C(C)=C(C)C(=O)Oc2c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.036 |
| logD: | -2.5511 |
| logSw: | -2.2138 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.394 |
| InChI Key: | QQTMBJGUWXTVJY-INSVYWFGSA-N |