methyl N-[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]-N-phenyl-beta-alaninate
Chemical Structure Depiction of
methyl N-[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]-N-phenyl-beta-alaninate
methyl N-[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]-N-phenyl-beta-alaninate
Compound characteristics
| Compound ID: | G305-0400 |
| Compound Name: | methyl N-[(2-oxo-1,3-benzoxazol-3(2H)-yl)acetyl]-N-phenyl-beta-alaninate |
| Molecular Weight: | 354.36 |
| Molecular Formula: | C19 H18 N2 O5 |
| Smiles: | COC(CCN(C(CN1C(=O)Oc2ccccc12)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0971 |
| logD: | 2.0971 |
| logSw: | -2.5047 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.991 |
| InChI Key: | QTKYQORICQQMJB-UHFFFAOYSA-N |