4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]isoleucinate
Chemical Structure Depiction of
4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]isoleucinate
4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]isoleucinate
Compound characteristics
| Compound ID: | Y041-1941 |
| Compound Name: | 4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]isoleucinate |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C25 H27 N O6 |
| Smiles: | CC[C@@H](C)[C@@H](C(=O)Oc1cc(C)cc2c1C(C)=CC(=O)O2)NC(=O)OCc1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.339 |
| logD: | 5.3389 |
| logSw: | -5.422 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.604 |
| InChI Key: | IYBSTHMSWBMYDF-MWTRTKDXSA-N |