4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Chemical Structure Depiction of
4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | Y041-1452 |
| Compound Name: | 4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate |
| Molecular Weight: | 487.51 |
| Molecular Formula: | C28 H25 N O7 |
| Smiles: | Cc1c(ccc2C(=CC(=O)Oc12)c1ccc(cc1)OC)OC(CCNC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5087 |
| logD: | 4.5087 |
| logSw: | -4.707 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.455 |
| InChI Key: | RSISKKNXJULSMV-UHFFFAOYSA-N |