3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-phenylalaninate
Chemical Structure Depiction of
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-phenylalaninate
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-phenylalaninate
Compound characteristics
| Compound ID: | Y041-1412 |
| Compound Name: | 3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-phenylalaninate |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C34 H29 N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OC([C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 6.9237 |
| logD: | 6.9237 |
| logSw: | -5.793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.767 |
| InChI Key: | OFRKAZITFQXOPA-PMERELPUSA-N |