4-ethyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Chemical Structure Depiction of
4-ethyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]-beta-alaninate
4-ethyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | Y041-1943 |
| Compound Name: | 4-ethyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl N-[(benzyloxy)carbonyl]-beta-alaninate |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C23 H23 N O6 |
| Smiles: | CCC1=CC(=O)Oc2cc(C)cc(c12)OC(CCNC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9914 |
| logD: | 3.9914 |
| logSw: | -4.3795 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.498 |
| InChI Key: | WTEIIGXILKGXSW-UHFFFAOYSA-N |