3-(4-fluorophenyl)-4-oxo-4H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
Chemical Structure Depiction of
3-(4-fluorophenyl)-4-oxo-4H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
3-(4-fluorophenyl)-4-oxo-4H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate
Compound characteristics
| Compound ID: | Y040-8027 |
| Compound Name: | 3-(4-fluorophenyl)-4-oxo-4H-1-benzopyran-7-yl N-[(benzyloxy)carbonyl]-L-alaninate |
| Molecular Weight: | 461.45 |
| Molecular Formula: | C26 H20 F N O6 |
| Smiles: | C[C@@H](C(=O)Oc1ccc2C(C(=COc2c1)c1ccc(cc1)F)=O)NC(=O)OCc1ccccc1 |
| Stereo: | ABSOLUTE |
| logP: | 4.5494 |
| logD: | 4.5494 |
| logSw: | -4.6854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.543 |
| InChI Key: | UBIIRXGLPAQBEU-INIZCTEOSA-N |