4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl (2R)-{[(benzyloxy)carbonyl]amino}(phenyl)acetate
Chemical Structure Depiction of
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl (2R)-{[(benzyloxy)carbonyl]amino}(phenyl)acetate
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl (2R)-{[(benzyloxy)carbonyl]amino}(phenyl)acetate
Compound characteristics
| Compound ID: | Y041-1531 |
| Compound Name: | 4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl (2R)-{[(benzyloxy)carbonyl]amino}(phenyl)acetate |
| Molecular Weight: | 457.48 |
| Molecular Formula: | C27 H23 N O6 |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2C)OC([C@@H](c1ccccc1)NC(=O)OCc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.8931 |
| logD: | 4.8929 |
| logSw: | -4.9223 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.017 |
| InChI Key: | DMMZBWMNNCNFRO-XMMPIXPASA-N |